data_2lup_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2lup _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' B' B ' 366' ' ' LEU . . . . . 0.516 ' N ' HD23 ' B' ' 366' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.455 -0.202 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.484 ' O ' ' HG2' ' B' ' 371' ' ' LYS . 21.1 t70 26.12 -96.6 0.01 OUTLIER 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.344 -179.3 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.575 ' CE ' ' ND2' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -41.7 -56.24 2.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.553 179.773 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . 0.575 ' ND2' ' CE ' ' B' ' 368' ' ' MET . 3.1 m-80 -62.97 -34.39 77.41 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.566 ' HA ' ' CD2' ' B' ' 432' ' ' LEU . . . -62.59 -72.15 0.14 Allowed 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.852 179.176 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.484 ' HG2' ' O ' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -39.15 -38.18 0.46 Allowed 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.648 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.529 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.6 OUTLIER -61.83 -46.47 89.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.234 179.259 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.507 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -60.98 -59.57 5.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.617 179.315 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.448 HD13 ' HB3' ' B' ' 428' ' ' ALA . 0.7 OUTLIER -46.36 -69.97 0.11 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.109 -0.951 . . . . 0.0 112.025 -179.464 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . 0.523 ' O ' ' N ' ' B' ' 379' ' ' GLY . 1.9 m-85 -72.03 -61.16 1.89 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -177.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.529 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.6 OUTLIER -55.58 -56.88 15.2 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -178.478 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.48 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.2 OUTLIER -72.2 -45.51 60.02 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -178.273 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.534 ' O ' ' CD1' ' B' ' 383' ' ' LEU . 11.3 mm -128.5 39.1 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.317 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' B' ' 375' ' ' TYR . . . -111.21 73.49 0.21 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.415 179.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.581 ' CD2' ' HD3' ' B' ' 445' ' ' ARG . 23.8 p90 -95.01 -164.64 1.19 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.669 0.271 . . . . 0.0 110.865 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . 0.575 ' O ' ' CE2' ' B' ' 380' ' ' TYR . . . -97.53 124.54 41.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.369 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 382' ' ' SER . . . . . 0.57 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 1.5 m 94.33 -10.93 0.12 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.97 179.253 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.534 ' CD1' ' O ' ' B' ' 378' ' ' ILE . 5.1 tt -45.49 -39.99 7.9 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.112 0.482 . . . . 0.0 110.532 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 13.9 tpt85 67.33 64.76 0.42 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.929 179.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.539 HD23 ' CE1' ' B' ' 387' ' ' TYR . 0.1 OUTLIER -58.45 157.46 8.82 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.347 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . 0.525 ' CB ' ' O ' ' B' ' 405' ' ' ARG . 0.0 OUTLIER -158.67 72.65 0.6 Allowed 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -178.822 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.579 ' CZ ' ' HB3' ' B' ' 404' ' ' CYS . 5.7 m-85 -86.67 95.56 9.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.849 0.357 . . . . 0.0 110.089 177.135 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . 0.506 HG21 ' CB ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -88.66 136.88 22.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.028 -179.7 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.2 m -97.12 126.43 42.29 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.084 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.522 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 28.0 m -132.33 153.21 37.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.5 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.545 ' O ' ' C ' ' B' ' 392' ' ' LYS . 6.6 tptt 87.3 21.87 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.501 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.545 ' C ' ' O ' ' B' ' 391' ' ' LYS . 6.7 mttp -8.72 122.41 0.02 OUTLIER Pre-proline 0 N--CA 1.472 0.647 0 O-C-N 123.839 0.712 . . . . 0.0 111.996 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.528 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 23.9 Cg_exo -62.83 163.04 23.17 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.787 2.325 . . . . 0.0 113.447 -178.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 394' ' ' THR . . . . . 0.523 ' CG2' ' OD1' ' B' ' 397' ' ' ASP . 0.1 OUTLIER -149.65 168.0 24.82 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.337 179.832 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -81.12 7.68 10.49 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.973 0.416 . . . . 0.0 111.159 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . 0.447 HG21 ' OG1' ' B' ' 394' ' ' THR . 5.2 m -129.26 13.59 2.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.425 0.631 . . . . 0.0 109.613 178.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . 0.523 ' OD1' ' CG2' ' B' ' 394' ' ' THR . 10.5 p30 163.51 63.12 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.382 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.528 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 75.9 Cg_exo -39.06 -51.35 2.5 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.852 2.368 . . . . 0.0 112.028 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.528 ' C ' ' O ' ' B' ' 398' ' ' PRO . 10.2 m120 -6.75 123.36 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.027 -0.988 . . . . 0.0 112.385 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 400' ' ' SER . . . . . 0.45 ' HB2' ' HG3' ' B' ' 393' ' ' PRO . 0.9 OUTLIER -140.49 137.97 34.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.581 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.528 HG13 ' N ' ' B' ' 402' ' ' VAL . 0.5 OUTLIER -114.26 141.73 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-O 120.995 0.426 . . . . 0.0 111.18 -179.769 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.528 ' N ' HG13 ' B' ' 401' ' ' ILE . 0.3 OUTLIER -107.87 152.41 9.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.277 -179.178 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.506 ' CB ' HG21 ' B' ' 388' ' ' VAL . 0.1 OUTLIER -115.63 98.91 6.97 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.217 178.931 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.579 ' HB3' ' CZ ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -78.43 92.32 4.59 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 179.325 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.581 ' HA ' ' O ' ' B' ' 410' ' ' THR . 5.7 ptp180 -139.14 157.45 45.93 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.498 -179.24 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.485 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 2.9 m -148.98 158.86 6.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.826 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 73.62 -1.61 43.96 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.82 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 14.6 t0 76.42 7.97 3.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.695 0.283 . . . . 0.0 111.246 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -157.76 17.61 0.34 Allowed Glycine 0 CA--C 1.519 0.338 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.92 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.581 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 0.2 OUTLIER -128.74 122.48 30.74 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 116.54 0.17 . . . . 0.0 111.044 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 36.0 t -113.21 103.45 15.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.602 0.239 . . . . 0.0 110.788 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.534 ' CD1' ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -67.79 -25.22 65.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.959 0.409 . . . . 0.0 110.024 179.546 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . 0.452 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 165.59 -165.36 37.89 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.313 -0.946 . . . . 0.0 112.843 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.473 ' CG2' ' O ' ' B' ' 402' ' ' VAL . 0.2 OUTLIER -150.68 157.41 42.93 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.657 0.265 . . . . 0.0 110.726 -179.766 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.48 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -149.73 152.29 24.26 Favored Glycine 0 C--O 1.226 -0.396 0 C-N-CA 120.044 -1.074 . . . . 0.0 113.226 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . 0.443 HG23 ' HB ' ' B' ' 401' ' ' ILE . 2.7 p -141.4 150.23 19.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.63 0.252 . . . . 0.0 110.898 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.536 ' HA3' ' CD1' ' B' ' 422' ' ' ILE . . . -163.0 161.34 33.81 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.445 -0.883 . . . . 0.0 112.608 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.524 ' N ' HD11 ' B' ' 422' ' ' ILE . 0.0 OUTLIER -74.92 -42.86 56.93 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.807 0.337 . . . . 0.0 111.31 -179.787 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.493 ' O ' HG13 ' B' ' 420' ' ' ILE . 0.7 OUTLIER -98.06 27.32 4.63 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.778 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.6 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 53.44 -44.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 178.903 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.626 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.6 OUTLIER -44.65 -56.8 4.09 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.975 -1.121 . . . . 0.0 107.975 179.867 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.626 ' N ' ' HD3' ' B' ' 421' ' ' LYS . 0.0 OUTLIER -46.29 -24.96 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.462 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 178.349 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.6 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -79.5 -48.74 13.38 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 177.434 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -58.65 -52.82 50.78 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.284 -1.126 . . . . 0.0 110.284 178.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . 0.516 ' N ' HD12 ' B' ' 425' ' ' ILE . 3.3 mm -58.43 -67.22 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 177.638 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.58 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 7.6 tpt180 -36.32 -32.16 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.237 178.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.492 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -64.5 -55.13 22.7 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.431 178.553 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.526 ' O ' HD23 ' B' ' 432' ' ' LEU . . . -56.88 -55.7 31.11 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.44 178.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.495 ' HA ' ' CD2' ' B' ' 432' ' ' LEU . 0.7 OUTLIER -53.5 -21.3 6.05 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.45 179.148 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.7 OUTLIER -75.65 -41.32 54.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.257 179.03 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.478 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -67.25 -37.72 83.99 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.753 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.566 ' CD2' ' HA ' ' B' ' 370' ' ' ALA . 0.7 OUTLIER -83.9 9.57 11.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.716 0.293 . . . . 0.0 111.108 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -92.27 -11.72 34.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.245 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . 0.475 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 32.7 m-20 -109.25 71.71 0.78 Allowed 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 120.687 0.279 . . . . 0.0 111.219 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.57 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -45.84 -54.01 8.79 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.433 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.57 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 7.5 mttt -48.19 -40.46 24.2 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.57 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.577 ' HE3' ' CE2' ' B' ' 441' ' ' TYR . 0.4 OUTLIER -77.73 -41.03 39.15 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 178.973 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.456 ' O ' HD12 ' B' ' 378' ' ' ILE . 95.7 mt -56.17 -65.04 0.67 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.966 179.173 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . 0.494 ' O ' ' N ' ' B' ' 442' ' ' ALA . 21.5 t70 -55.92 -46.42 78.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.267 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.468 ' HB2' ' O ' ' B' ' 436' ' ' LYS . 8.2 t80 -41.97 -45.12 3.71 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.28 -0.873 . . . . 0.0 108.903 179.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.577 ' CE2' ' HE3' ' B' ' 437' ' ' MET . 16.6 m-30 -67.62 -37.56 82.67 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.487 178.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . 0.494 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -47.61 -61.77 1.77 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 178.285 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.83 -57.34 11.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.643 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . 0.422 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -41.92 -62.88 0.82 Allowed 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.232 0.539 . . . . 0.0 110.36 179.011 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.581 ' HD3' ' CD2' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -43.22 -37.35 2.1 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.819 179.172 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -76.74 -41.05 46.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.919 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.322 -179.656 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 366' ' ' LEU . . . . . 0.411 HD11 ' HA ' ' B' ' 366' ' ' LEU . 2.8 tp . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.878 0.371 . . . . 0.0 111.347 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.54 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -45.67 -71.88 0.07 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.354 179.601 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.58 ' CE ' ' CB ' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -38.58 -35.48 0.19 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.14 -179.129 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . 0.58 ' CB ' ' CE ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -67.71 -39.38 84.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.027 0.441 . . . . 0.0 109.904 179.779 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.54 ' N ' ' O ' ' B' ' 367' ' ' ASP . . . -62.27 -69.99 0.22 Allowed 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.134 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.543 ' HE3' ' N ' ' B' ' 368' ' ' MET . 0.4 OUTLIER -37.23 -44.93 0.61 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.13 179.428 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.547 ' O ' ' CB ' ' B' ' 376' ' ' SER . 1.4 tmm_? -56.27 -40.68 74.63 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.897 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.517 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -64.26 -48.51 75.47 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.076 0.465 . . . . 0.0 111.273 179.871 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.529 ' CD2' HD22 ' B' ' 432' ' ' LEU . 0.3 OUTLIER -59.72 -70.18 0.17 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -178.128 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . 0.509 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 4.6 m-85 -72.51 -34.49 67.65 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -177.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.547 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -83.58 -54.96 4.56 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.561 -179.323 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.502 ' CB ' ' O ' ' B' ' 373' ' ' GLN . 0.2 OUTLIER -72.68 -35.84 67.77 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.625 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.507 HG13 HD23 ' B' ' 438' ' ' LEU . 3.9 mm -137.01 36.78 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -178.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.509 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -127.04 90.71 0.36 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.212 -0.994 . . . . 0.0 112.824 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.498 ' CE2' ' HG ' ' B' ' 383' ' ' LEU . 52.3 p90 -99.74 -160.08 0.78 Allowed 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.397 -0.223 . . . . 0.0 110.397 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . 0.539 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -93.61 123.03 36.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.8 0.333 . . . . 0.0 111.622 -179.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 382' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 3.2 m 87.78 -3.66 0.56 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.017 179.03 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.501 ' CD1' ' O ' ' B' ' 378' ' ' ILE . 6.2 tt -50.63 -43.67 57.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.807 0.337 . . . . 0.0 111.143 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . 0.464 ' O ' HG12 ' B' ' 406' ' ' VAL . 0.1 OUTLIER 69.84 74.09 0.23 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.674 -179.827 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.57 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 9.9 tt -118.68 128.95 55.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.124 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 41.1 p-80 -149.51 146.99 27.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.65 0.738 . . . . 0.0 112.85 -178.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.607 ' CZ ' ' HB3' ' B' ' 404' ' ' CYS . 2.8 m-85 -101.66 141.75 34.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.661 -1.154 . . . . 0.0 110.532 178.558 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -124.27 119.52 56.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.204 0.526 . . . . 0.0 110.777 179.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.8 m -80.12 122.99 27.49 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.817 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.563 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 31.5 m -131.86 161.01 42.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.76 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.563 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.2 OUTLIER 94.65 21.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.424 -179.908 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.533 ' O ' ' O ' ' B' ' 391' ' ' LYS . 0.7 OUTLIER 4.24 118.94 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.741 0 O-C-N 124.095 0.872 . . . . 0.0 112.829 179.742 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.5 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 7.0 Cg_exo -68.58 157.03 63.52 Favored 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.615 2.21 . . . . 0.0 113.586 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -137.24 171.77 13.99 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.472 -1.24 . . . . 0.0 111.981 -179.624 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -93.39 18.75 9.23 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-O 121.289 0.566 . . . . 0.0 110.442 179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 34.6 m -135.67 -0.53 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.195 178.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . 0.434 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 1.6 m-20 179.25 56.24 0.06 OUTLIER Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 114.871 -1.059 . . . . 0.0 108.852 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.5 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 73.7 Cg_exo -38.57 -35.75 0.51 Allowed 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 123.282 2.654 . . . . 0.0 112.902 -179.251 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.6 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -30.51 134.3 0.06 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.543 0.687 . . . . 0.0 112.212 -178.208 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 400' ' ' SER . . . . . 0.482 ' OG ' ' HG3' ' B' ' 393' ' ' PRO . 45.8 m -143.24 151.68 40.86 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.338 -179.681 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.539 ' CG2' HG21 ' B' ' 390' ' ' VAL . 10.2 tt -109.99 156.12 11.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.962 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.526 ' CG2' ' O ' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -121.19 152.98 24.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.641 -178.369 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.447 ' O ' ' HA ' ' B' ' 387' ' ' TYR . 2.8 mt-10 -121.24 122.6 40.29 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.764 178.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.607 ' HB3' ' CZ ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -109.97 108.1 18.23 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 179.163 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.503 ' HA ' ' O ' ' B' ' 410' ' ' THR . 1.2 ptm180 -134.58 -170.02 2.46 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.683 0.754 . . . . 0.0 112.713 -178.455 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.57 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -158.64 157.75 3.16 Favored 'Isoleucine or valine' 0 C--O 1.243 0.72 0 CA-C-N 114.492 -1.231 . . . . 0.0 112.003 -178.686 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 59.0 -95.08 0.06 OUTLIER Glycine 0 N--CA 1.448 -0.55 0 CA-C-N 114.737 -1.12 . . . . 0.0 111.957 -179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -167.08 27.1 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.753 0.311 . . . . 0.0 110.366 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 177.08 26.51 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 119.997 -1.097 . . . . 0.0 113.528 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.503 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 87.4 m -130.53 109.09 10.42 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 117.168 0.484 . . . . 0.0 110.815 178.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . 0.476 ' HA ' ' HA ' ' B' ' 405' ' ' ARG . 74.1 t -101.85 116.09 44.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.654 0.264 . . . . 0.0 110.521 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.515 ' N ' ' O ' ' B' ' 404' ' ' CYS . 0.4 OUTLIER -71.58 -35.38 70.53 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.411 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . 0.498 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 172.38 -176.07 45.42 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.15 -1.024 . . . . 0.0 112.875 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.44 ' O ' ' CG ' ' B' ' 430' ' ' ASN . 0.5 OUTLIER -145.7 155.94 43.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.728 0.299 . . . . 0.0 111.294 -179.369 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.537 ' HA3' ' CG ' ' B' ' 426' ' ' ARG . . . -149.41 135.48 5.36 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.301 -0.952 . . . . 0.0 112.686 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . 0.464 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 8.8 p -125.87 152.51 33.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.76 0.314 . . . . 0.0 110.506 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.6 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -159.95 167.24 35.33 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.503 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.535 ' CG ' ' OD1' ' B' ' 419' ' ' ASN . 7.4 ptm180 -71.23 -41.92 69.53 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -179.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.535 ' OD1' ' CG ' ' B' ' 418' ' ' ARG . 0.3 OUTLIER -107.28 34.15 3.64 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.673 0.273 . . . . 0.0 110.802 179.575 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.579 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.7 OUTLIER 55.99 -42.57 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 179.292 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.536 ' N ' HG13 ' B' ' 420' ' ' ILE . 0.0 OUTLIER -45.0 -61.47 1.61 Allowed 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 118.954 0.797 . . . . 0.0 109.721 -179.795 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.594 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.0 OUTLIER -45.31 -21.9 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 177.851 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.579 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -86.19 -50.53 6.91 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.595 178.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -57.46 -42.52 93.9 Favored Glycine 0 C--N 1.337 0.624 0 C-N-CA 120.083 -1.056 . . . . 0.0 110.998 179.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . 0.538 ' CD1' ' N ' ' B' ' 425' ' ' ILE . 0.6 OUTLIER -71.16 -63.38 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.237 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.594 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 12.2 tpt180 -41.37 -31.29 0.23 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.681 178.373 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.509 ' CB ' ' HB ' ' B' ' 402' ' ' VAL . . . -64.51 -60.35 3.24 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.449 178.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.535 ' HB2' ' CB ' ' B' ' 370' ' ' ALA . . . -57.84 -51.9 67.68 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.54 ' O ' ' HB2' ' B' ' 433' ' ' ARG . 79.7 mm-40 -55.33 -21.59 15.61 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.079 178.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.505 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.6 OUTLIER -76.71 -38.81 53.7 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.138 178.881 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.485 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -62.42 -32.68 73.56 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.328 0.585 . . . . 0.0 109.49 179.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.535 ' CD2' ' O ' ' B' ' 428' ' ' ALA . 0.2 OUTLIER -96.99 3.63 51.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.071 178.709 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . 0.54 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 0.0 OUTLIER -89.89 19.72 4.65 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.795 -179.964 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . 0.514 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 15.5 m-20 -136.19 80.67 1.84 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.384 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.576 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.3 OUTLIER -47.18 -57.25 5.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.211 -179.905 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.576 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 2.5 mtmt -49.3 -42.49 41.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.28 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.514 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 0.5 OUTLIER -70.49 -50.31 39.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.585 179.603 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.507 HD23 HG13 ' B' ' 378' ' ' ILE . 85.4 mt -50.78 -59.58 3.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.469 0.652 . . . . 0.0 110.489 179.402 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -59.09 -42.66 90.99 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.47 178.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.505 ' C ' ' CD1' ' B' ' 440' ' ' PHE . 0.1 OUTLIER -42.81 -48.96 5.8 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 179.368 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.456 ' O ' ' C ' ' B' ' 442' ' ' ALA . 55.1 m-85 -62.57 -46.3 88.98 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.56 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . 0.456 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -39.12 -61.69 0.73 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 178.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 1.4 tmtt? -49.47 -49.92 43.47 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 178.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . 0.528 ' O ' ' N ' ' B' ' 447' ' ' ALA . 0.0 OUTLIER -51.04 -59.01 4.62 Favored 'General case' 0 C--N 1.334 -0.085 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 178.878 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.478 ' HD3' ' HB3' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -38.1 -41.67 0.6 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.495 178.999 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -69.46 -38.16 77.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.896 179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 447' ' ' ALA . . . . . 0.528 ' N ' ' O ' ' B' ' 444' ' ' GLN . . . . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.696 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 366' ' ' LEU . . . . . 0.432 ' HB3' ' HB2' ' B' ' 369' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.455 -0.193 0 CA-C-O 120.917 0.389 . . . . 0.0 110.906 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.494 ' CA ' HG23 ' B' ' 425' ' ' ILE . 33.9 t0 -61.04 -61.28 2.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.256 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.468 ' HA ' ' CE ' ' B' ' 371' ' ' LYS . 2.1 tmm? -35.51 -53.61 0.67 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.496 179.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . 0.465 ' HA ' ' HE3' ' B' ' 368' ' ' MET . 1.1 m-80 -60.19 -45.49 92.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.28 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.582 ' CB ' ' CB ' ' B' ' 428' ' ' ALA . . . -61.36 -71.7 0.14 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.244 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' B' ' 367' ' ' ASP . 0.1 OUTLIER -34.94 -50.75 0.49 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.901 0.381 . . . . 0.0 110.473 -179.836 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.575 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.3 OUTLIER -55.56 -41.59 73.5 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.881 179.669 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.533 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.3 OUTLIER -66.1 -61.06 2.24 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.141 0.496 . . . . 0.0 110.798 179.601 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.544 ' CD1' ' CB ' ' B' ' 428' ' ' ALA . 0.4 OUTLIER -46.79 -73.24 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.577 0.955 . . . . 0.0 113.577 -178.571 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . 0.468 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.5 m-85 -92.3 -4.93 53.24 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -176.496 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.575 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -113.72 5.28 16.35 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.078 -0.649 . . . . 0.0 110.66 179.122 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.503 HD22 ' OE1' ' B' ' 373' ' ' GLN . 3.7 tp -144.51 -35.85 0.34 Allowed 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.281 179.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.491 ' O ' HD23 ' B' ' 383' ' ' LEU . 5.5 mm -135.36 38.21 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -179.595 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.498 ' HA2' HD21 ' B' ' 383' ' ' LEU . . . -149.81 68.18 0.34 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.591 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.564 ' CG ' ' HD3' ' B' ' 445' ' ' ARG . 15.1 p90 -74.97 -50.9 15.09 Favored 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 121.071 -0.251 . . . . 0.0 110.696 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . 0.538 ' CB ' ' O ' ' B' ' 380' ' ' TYR . . . 158.04 -14.75 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 178.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -124.0 31.69 5.76 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -178.456 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.498 HD21 ' HA2' ' B' ' 379' ' ' GLY . 0.1 OUTLIER -101.0 -8.92 21.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.855 0.359 . . . . 0.0 110.537 178.703 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 57.4 44.05 22.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.145 -0.479 . . . . 0.0 109.95 -179.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.553 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 9.8 tt -90.96 125.84 35.9 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . 0.514 ' O ' ' O ' ' B' ' 405' ' ' ARG . 2.3 p-80 -144.96 148.89 34.31 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 -178.525 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.414 ' CE1' HD21 ' B' ' 385' ' ' LEU . 18.2 m-85 -109.63 148.91 30.49 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.738 -1.119 . . . . 0.0 109.549 177.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . 0.514 HG21 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -125.18 125.44 69.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.149 0.5 . . . . 0.0 110.699 179.44 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 389' ' ' THR . . . . . 0.522 ' CG2' ' O ' ' B' ' 389' ' ' THR . 0.5 OUTLIER -83.84 117.0 23.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.453 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.561 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 33.9 m -130.52 146.74 33.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.156 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.561 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.3 OUTLIER 94.0 19.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.092 -179.812 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.516 ' C ' ' O ' ' B' ' 391' ' ' LYS . 6.4 mttt -6.27 108.32 0.03 OUTLIER Pre-proline 0 N--CA 1.469 0.479 0 O-C-N 123.952 0.782 . . . . 0.0 112.579 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.511 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 5.5 Cg_exo -47.51 157.14 0.9 Allowed 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 122.661 2.241 . . . . 0.0 113.195 -179.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 394' ' ' THR . . . . . 0.491 ' O ' ' HD3' ' B' ' 398' ' ' PRO . 1.3 p -150.35 164.95 34.51 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.934 -1.03 . . . . 0.0 111.429 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -78.18 5.93 9.18 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.842 0.353 . . . . 0.0 111.297 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . 0.481 ' O ' ' HB2' ' B' ' 397' ' ' ASP . 4.3 m -132.1 12.84 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.454 0.645 . . . . 0.0 109.352 178.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . 0.481 ' HB2' ' O ' ' B' ' 396' ' ' VAL . 32.1 t70 172.56 56.82 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.153 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.511 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 1.5 Cg_endo -44.41 -61.09 0.63 Allowed 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 123.253 2.635 . . . . 0.0 111.856 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.561 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 1.1 p-10 -22.72 137.04 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.899 -1.046 . . . . 0.0 112.221 -179.212 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 45.9 t -140.57 154.78 46.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.945 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.551 HG13 ' N ' ' B' ' 402' ' ' VAL . 0.4 OUTLIER -116.72 142.88 28.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.317 -179.742 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.551 ' N ' HG13 ' B' ' 401' ' ' ILE . 0.2 OUTLIER -107.4 156.35 7.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.666 -179.764 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.514 ' CB ' HG21 ' B' ' 388' ' ' VAL . 0.0 OUTLIER -121.6 110.48 16.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.258 179.114 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.519 ' O ' ' N ' ' B' ' 412' ' ' LEU . 5.7 t -90.5 100.09 12.99 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.855 179.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.514 ' O ' ' O ' ' B' ' 386' ' ' HIS . 6.3 ptm180 -143.25 161.99 36.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.392 0.615 . . . . 0.0 111.889 -178.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.553 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 5.3 m -142.13 151.01 18.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.289 179.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 71.32 3.58 53.67 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.02 -1.086 . . . . 0.0 112.081 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 69.28 21.96 6.85 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.737 0.304 . . . . 0.0 110.78 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -146.25 -46.66 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.424 -0.893 . . . . 0.0 113.182 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.482 ' O ' ' HB2' ' B' ' 405' ' ' ARG . 69.0 m -80.41 125.77 30.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.863 0.364 . . . . 0.0 111.669 -179.365 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 52.9 t -107.88 104.15 16.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.908 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.519 ' N ' ' O ' ' B' ' 404' ' ' CYS . 0.1 OUTLIER -61.47 -26.07 67.65 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.586 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 160.02 -154.14 25.16 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.466 -0.788 . . . . 0.0 112.3 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.501 ' N ' ' OD1' ' B' ' 430' ' ' ASN . 4.6 t -163.25 162.8 25.47 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.108 0.48 . . . . 0.0 111.797 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.521 ' CA ' ' HG2' ' B' ' 426' ' ' ARG . . . -148.04 151.06 23.34 Favored Glycine 0 C--O 1.224 -0.509 0 C-N-CA 120.343 -0.932 . . . . 0.0 113.148 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . 0.442 ' HB ' HD11 ' B' ' 401' ' ' ILE . 5.5 p -142.8 149.6 18.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.728 0.299 . . . . 0.0 110.992 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.561 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -161.3 170.49 37.09 Favored Glycine 0 C--O 1.227 -0.334 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.345 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.555 ' N ' HD13 ' B' ' 422' ' ' ILE . 0.0 OUTLIER -81.95 -44.0 17.33 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 116.903 0.351 . . . . 0.0 111.411 179.951 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.593 ' O ' ' N ' ' B' ' 421' ' ' LYS . 0.2 OUTLIER -99.99 37.08 1.7 Allowed 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 179.52 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.602 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 48.27 -46.47 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 N-CA-C 115.2 1.556 . . . . 0.0 115.2 178.468 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.651 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -43.3 -56.5 3.48 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -179.51 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.651 ' N ' ' HD3' ' B' ' 421' ' ' LYS . 0.0 OUTLIER -47.37 -22.26 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.887 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.602 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -83.17 -46.65 12.48 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 177.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -58.94 -51.5 58.82 Favored Glycine 0 C--N 1.334 0.431 0 N-CA-C 110.271 -1.131 . . . . 0.0 110.271 177.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . 0.548 ' CD1' ' N ' ' B' ' 425' ' ' ILE . 0.9 OUTLIER -61.5 -66.33 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 177.893 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.595 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 7.0 tpt180 -39.02 -32.93 0.1 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.551 179.167 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.484 ' HB2' ' O ' ' B' ' 424' ' ' GLY . . . -62.88 -57.67 10.03 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 178.422 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.582 ' CB ' ' CB ' ' B' ' 370' ' ' ALA . . . -58.24 -53.78 54.44 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.235 178.317 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.499 ' HA ' ' CD2' ' B' ' 432' ' ' LEU . 0.5 OUTLIER -54.47 -17.33 3.03 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.936 179.229 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.501 ' OD1' ' N ' ' B' ' 414' ' ' THR . 1.1 m-80 -81.77 -36.75 28.14 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 178.436 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . . . . . . . . . . . -68.4 -39.43 81.68 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.349 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.55 ' CD2' ' HA ' ' B' ' 370' ' ' ALA . 0.8 OUTLIER -83.24 10.27 8.81 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.85 0.357 . . . . 0.0 111.013 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -86.95 -8.11 57.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.455 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . 0.432 ' O ' ' HG ' ' B' ' 438' ' ' LEU . 1.1 m-20 -117.8 80.52 1.52 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.655 -179.381 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.569 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 1.9 ptpp? -49.68 -54.32 19.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.242 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.569 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -50.35 -39.01 45.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.098 0.475 . . . . 0.0 110.203 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.505 ' CE ' ' HG ' ' B' ' 412' ' ' LEU . 0.8 OUTLIER -76.52 -40.96 48.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.811 178.927 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.499 HD21 ' HA ' ' B' ' 432' ' ' LEU . 83.4 mt -58.36 -64.54 0.89 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.985 179.156 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -49.88 -43.35 49.29 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 178.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.485 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -45.32 -42.49 9.91 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.382 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.493 ' HA ' ' HG2' ' B' ' 444' ' ' GLN . 41.8 m-85 -66.62 -45.78 77.96 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.858 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . 0.487 ' O ' ' N ' ' B' ' 445' ' ' ARG . . . -41.99 -59.74 1.64 Allowed 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.552 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -49.92 -44.59 50.43 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 178.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . 0.493 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -63.12 -12.09 24.86 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.65 179.318 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.564 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -90.41 -36.85 14.35 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.821 -179.746 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -85.74 -37.4 19.39 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.939 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.801 -179.59 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 366' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.457 -0.101 0 CA-C-O 120.796 0.332 . . . . 0.0 111.017 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.53 ' HB3' ' CG1' ' B' ' 425' ' ' ILE . 0.3 OUTLIER -54.67 -68.48 0.18 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 179.44 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.521 ' N ' ' HE2' ' B' ' 371' ' ' LYS . 12.5 tmm? -34.84 -45.59 0.26 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.491 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -62.57 -44.41 96.39 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.872 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.556 ' O ' ' N ' ' B' ' 373' ' ' GLN . . . -60.36 -69.68 0.21 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 179.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.521 ' HE2' ' N ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -34.13 -51.02 0.42 Allowed 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.509 179.894 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.559 ' O ' ' CB ' ' B' ' 376' ' ' SER . 2.3 tmm_? -56.96 -40.05 75.76 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.783 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.556 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -62.28 -59.03 5.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.121 0.486 . . . . 0.0 110.322 178.846 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.541 ' CD2' HD23 ' B' ' 432' ' ' LEU . 1.7 mt -47.56 -72.65 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.3 -0.864 . . . . 0.0 113.162 -178.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . 0.451 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 24.9 m-85 -74.18 -48.45 29.04 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 -176.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.559 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -63.25 -54.6 34.7 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.652 -178.576 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.46 ' O ' HD11 ' B' ' 378' ' ' ILE . 0.2 OUTLIER -71.78 -43.85 65.0 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -178.331 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.468 HD13 ' O ' ' B' ' 438' ' ' LEU . 8.7 mm -114.59 -58.98 3.34 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -177.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.451 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -63.56 66.44 0.04 OUTLIER Glycine 0 CA--C 1.516 0.131 0 C-N-CA 121.14 -0.553 . . . . 0.0 113.117 -179.123 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.599 ' CD1' ' HG2' ' B' ' 445' ' ' ARG . 10.4 p90 -49.01 -35.45 15.43 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 111.567 0.21 . . . . 0.0 111.567 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . 0.568 ' CB ' ' O ' ' B' ' 380' ' ' TYR . . . 151.48 -10.31 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.586 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 382' ' ' SER . . . . . 0.487 ' O ' ' OH ' ' B' ' 380' ' ' TYR . 0.3 OUTLIER -147.43 50.85 1.07 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.916 0.389 . . . . 0.0 110.426 179.715 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.462 ' CD1' HG23 ' B' ' 378' ' ' ILE . 0.8 OUTLIER -106.13 -15.67 14.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.793 -179.961 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . 0.502 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 0.2 OUTLIER 65.89 60.6 0.67 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.111 179.808 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.566 ' HG ' ' CG1' ' B' ' 406' ' ' VAL . 2.6 tt -105.67 124.62 49.85 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . 0.544 ' O ' ' O ' ' B' ' 405' ' ' ARG . 15.2 p-80 -144.0 148.27 35.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.612 0.72 . . . . 0.0 112.746 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.516 ' CE2' ' HB1' ' B' ' 427' ' ' ALA . 35.3 m-85 -107.23 144.69 33.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.388 -0.823 . . . . 0.0 111.266 179.077 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . 0.476 HG23 ' HB3' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -125.83 125.92 69.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.762 179.332 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.1 m -88.01 122.43 31.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.209 -179.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.537 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 18.2 m -125.1 157.64 33.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.192 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.537 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.2 OUTLIER 89.56 24.07 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.197 179.954 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.52 ' C ' ' O ' ' B' ' 391' ' ' LYS . 8.2 mmpt? 5.44 108.51 0.01 OUTLIER Pre-proline 0 N--CA 1.471 0.605 0 O-C-N 123.938 0.774 . . . . 0.0 112.317 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.454 ' HD2' ' HA ' ' B' ' 392' ' ' LYS . 3.3 Cg_endo -51.31 162.57 1.29 Allowed 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.709 2.273 . . . . 0.0 113.891 -179.119 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 2.5 p -126.58 160.2 31.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.573 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -91.78 20.35 5.68 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-O 121.316 0.579 . . . . 0.0 110.573 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . 0.451 ' O ' ' HB2' ' B' ' 397' ' ' ASP . 23.1 m -138.32 13.52 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.323 177.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . 0.47 ' O ' ' N ' ' B' ' 399' ' ' ASN . 0.7 OUTLIER 159.23 64.28 0.0 OUTLIER Pre-proline 0 N--CA 1.451 -0.392 0 CA-C-N 114.659 -1.155 . . . . 0.0 108.79 -179.238 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.518 ' O ' ' C ' ' B' ' 399' ' ' ASN . 83.4 Cg_exo -37.34 -23.2 0.05 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.322 0 C-N-CA 123.63 2.886 . . . . 0.0 113.676 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.518 ' C ' ' O ' ' B' ' 398' ' ' PRO . 21.1 m120 -20.57 109.4 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.271 0 O-C-N 123.537 0.523 . . . . 0.0 111.537 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 38.1 t -131.78 146.3 52.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.256 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.562 HD11 ' N ' ' B' ' 402' ' ' VAL . 0.0 OUTLIER -108.29 151.76 10.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.37 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.562 ' N ' HD11 ' B' ' 401' ' ' ILE . 0.2 OUTLIER -119.45 157.93 21.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.781 -178.692 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.476 ' HB3' HG23 ' B' ' 388' ' ' VAL . 0.7 OUTLIER -121.34 118.31 29.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.741 178.895 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.546 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -93.09 98.53 11.38 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.222 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.544 ' O ' ' O ' ' B' ' 386' ' ' HIS . 1.0 OUTLIER -133.69 158.2 43.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.348 0.594 . . . . 0.0 112.033 -178.291 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.566 ' CG1' ' HG ' ' B' ' 385' ' ' LEU . 2.6 m -138.88 178.65 3.77 Favored 'Isoleucine or valine' 0 C--O 1.238 0.463 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.234 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . 0.436 ' O ' ' HG2' ' B' ' 384' ' ' ARG . . . 64.77 -92.55 0.13 Allowed Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.898 -0.667 . . . . 0.0 112.375 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -163.64 25.94 0.08 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.902 0.382 . . . . 0.0 110.588 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . 0.48 ' HA2' ' NE ' ' B' ' 405' ' ' ARG . . . 163.66 -12.56 0.09 OUTLIER Glycine 0 CA--C 1.522 0.477 0 C-N-CA 120.445 -0.883 . . . . 0.0 113.643 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.542 ' O ' ' CB ' ' B' ' 405' ' ' ARG . 42.4 m -71.8 134.24 46.03 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 117.531 0.665 . . . . 0.0 110.646 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . 0.435 ' HA ' ' HA ' ' B' ' 405' ' ' ARG . 80.3 t -119.18 114.11 43.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.742 0.306 . . . . 0.0 111.733 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.546 ' N ' ' O ' ' B' ' 404' ' ' CYS . 0.2 OUTLIER -75.29 -32.45 61.0 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.145 179.024 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . 0.457 ' O ' ' SG ' ' B' ' 404' ' ' CYS . . . 174.4 -168.74 41.58 Favored Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.003 -1.094 . . . . 0.0 113.319 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.454 ' N ' ' OD1' ' B' ' 430' ' ' ASN . 0.1 OUTLIER -146.42 158.46 43.89 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.572 -0.314 . . . . 0.0 111.612 -179.161 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.586 ' CA ' ' CG ' ' B' ' 426' ' ' ARG . . . -152.06 138.11 6.3 Favored Glycine 0 C--O 1.225 -0.418 0 C-N-CA 120.451 -0.881 . . . . 0.0 112.833 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . 0.482 HG21 ' N ' ' B' ' 417' ' ' GLY . 12.9 p -119.63 150.3 22.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 179.402 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.489 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -159.73 148.6 17.42 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.267 -0.968 . . . . 0.0 112.262 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.502 ' N ' HD12 ' B' ' 422' ' ' ILE . 4.3 ptt85 -67.51 -42.47 82.78 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.788 0.327 . . . . 0.0 111.434 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.532 ' O ' HG13 ' B' ' 420' ' ' ILE . 0.1 OUTLIER -100.3 26.74 6.26 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.959 179.358 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.598 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 55.14 -46.21 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 179.597 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.516 ' O ' ' N ' ' B' ' 424' ' ' GLY . 0.0 OUTLIER -44.53 -58.51 2.95 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 119.913 -0.715 . . . . 0.0 109.239 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.612 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.1 OUTLIER -46.0 -27.92 0.75 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.426 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 177.563 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.598 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -70.97 -51.09 27.71 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 176.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -61.11 -44.2 98.46 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.23 -0.986 . . . . 0.0 111.474 178.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . 0.53 ' CG1' ' HB3' ' B' ' 367' ' ' ASP . 1.4 mp -81.63 -3.45 6.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 120.715 0.293 . . . . 0.0 111.391 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.612 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -96.71 -29.67 13.66 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 176.839 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.516 ' HB1' ' CE2' ' B' ' 387' ' ' TYR . . . -69.95 -42.58 73.04 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.531 -1.285 . . . . 0.0 107.531 176.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.51 ' O ' ' CD2' ' B' ' 432' ' ' LEU . . . -63.13 -56.93 12.6 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.406 ' HB2' ' O ' ' B' ' 425' ' ' ILE . 0.0 OUTLIER -51.41 -22.06 2.73 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.574 178.231 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.454 ' OD1' ' N ' ' B' ' 414' ' ' THR . 0.9 OUTLIER -79.47 -39.25 32.65 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.955 179.166 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.455 ' O ' HD22 ' B' ' 438' ' ' LEU . . . -67.25 -30.42 70.32 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.146 -179.281 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.542 ' CB ' ' HG3' ' B' ' 373' ' ' GLN . 0.2 OUTLIER -95.47 8.24 43.85 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.877 179.772 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.73 -17.23 36.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.077 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . 0.539 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 0.7 OUTLIER -102.85 82.94 2.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.163 -179.12 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.569 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 12.0 ptmt -52.15 -54.69 27.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.924 0.392 . . . . 0.0 110.053 179.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.569 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 1.5 mmpt? -51.73 -42.67 62.48 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.59 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.539 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 0.2 OUTLIER -71.78 -48.99 42.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.004 0.43 . . . . 0.0 110.145 179.188 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.538 ' CD1' ' HA ' ' B' ' 432' ' ' LEU . 83.1 mt -52.97 -60.9 2.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.433 0.635 . . . . 0.0 110.019 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . 0.519 ' O ' ' N ' ' B' ' 442' ' ' ALA . 29.1 t70 -56.01 -44.35 78.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.264 -0.88 . . . . 0.0 108.897 178.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.478 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.6 OUTLIER -43.38 -45.01 5.96 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 179.343 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.477 ' O ' ' HB2' ' B' ' 444' ' ' GLN . 45.5 m-85 -64.85 -39.42 93.53 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.936 178.368 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . 0.519 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -45.34 -62.54 1.22 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.069 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -45.87 -48.92 15.89 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 178.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . 0.477 ' HB2' ' O ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -50.2 -54.58 19.94 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.037 178.148 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.599 ' HG2' ' CD1' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -41.71 -42.77 2.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.13 179.048 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -72.42 -38.0 68.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.286 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.022 -179.205 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 366' ' ' LEU . . . . . 0.483 ' O ' ' HB2' ' B' ' 369' ' ' ASN . 7.5 mt . . . . . 0 CA--C 1.52 -0.204 0 CA-C-O 120.628 0.251 . . . . 0.0 111.352 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.514 ' HA ' ' CG2' ' B' ' 425' ' ' ILE . 0.0 OUTLIER -45.75 -71.92 0.07 Allowed 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 178.844 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.603 ' CE ' ' ND2' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -34.37 -44.61 0.2 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.558 179.311 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . 0.603 ' ND2' ' CE ' ' B' ' 368' ' ' MET . 4.5 m-20 -56.33 -52.18 65.51 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.916 0.388 . . . . 0.0 110.529 179.25 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.527 ' CB ' ' HB1' ' B' ' 428' ' ' ALA . . . -61.22 -70.7 0.17 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.67 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.426 ' C ' ' O ' ' B' ' 370' ' ' ALA . 0.3 OUTLIER -36.6 -38.82 0.18 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.134 0.493 . . . . 0.0 110.428 179.924 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.572 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.0 OUTLIER -65.34 -42.32 92.98 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.883 179.799 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.552 ' HG3' ' CB ' ' B' ' 432' ' ' LEU . 0.1 OUTLIER -59.14 -44.75 92.07 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.583 0.706 . . . . 0.0 110.264 179.136 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.434 HD11 HD22 ' B' ' 385' ' ' LEU . 2.3 mm? -58.68 -69.77 0.18 Allowed 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 -178.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . 0.459 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 5.2 m-30 -96.67 12.03 33.28 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -176.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.572 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.7 OUTLIER -129.81 -1.3 4.78 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.571 179.268 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.536 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 8.8 mp -140.25 -27.52 0.75 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.279 178.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.468 ' O ' HD12 ' B' ' 383' ' ' LEU . 4.5 mm -144.38 39.25 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.169 0 CA-C-O 120.644 0.259 . . . . 0.0 111.536 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.459 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -121.72 97.41 0.61 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.895 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.574 ' CE1' ' HB2' ' B' ' 383' ' ' LEU . 46.4 p90 -124.11 -172.98 2.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.639 0.257 . . . . 0.0 110.634 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . 0.505 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -96.36 83.17 3.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.42 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 382' ' ' SER . . . . . 0.505 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 3.2 t 157.7 -34.8 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.103 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.574 ' HB2' ' CE1' ' B' ' 380' ' ' TYR . 1.2 tt -45.84 -42.18 12.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.744 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . 0.483 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 0.9 OUTLIER 62.55 59.58 1.47 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.761 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.557 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 7.0 tt -101.32 132.64 46.76 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.869 -179.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . 0.459 ' O ' ' O ' ' B' ' 405' ' ' ARG . 24.9 p-80 -149.78 151.9 34.32 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.3 0.572 . . . . 0.0 112.419 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.58 ' CE2' ' HB3' ' B' ' 404' ' ' CYS . 7.1 m-85 -107.26 150.01 27.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.009 178.402 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . 0.449 HG22 ' HB3' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -132.42 129.88 59.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.0 179.463 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.3 m -92.31 124.29 36.26 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.661 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.498 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 24.2 m -128.3 158.01 40.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.161 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.523 ' O ' ' C ' ' B' ' 392' ' ' LYS . 4.0 tptp 85.82 23.34 0.08 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.67 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.523 ' C ' ' O ' ' B' ' 391' ' ' LYS . 64.2 mmtt -1.29 119.63 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.693 0 O-C-N 124.104 0.877 . . . . 0.0 112.475 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.509 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 17.8 Cg_exo -63.1 159.9 36.72 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.565 2.177 . . . . 0.0 113.077 -179.482 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 394' ' ' THR . . . . . 0.459 ' O ' ' HD3' ' B' ' 398' ' ' PRO . 3.1 p -151.79 167.84 26.96 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.621 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -84.67 10.83 10.2 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.161 0.505 . . . . 0.0 110.73 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . 0.452 HG21 ' OG1' ' B' ' 394' ' ' THR . 13.8 m -130.42 17.37 2.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 108.841 -0.799 . . . . 0.0 108.841 178.148 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . 0.449 ' CB ' ' O ' ' B' ' 396' ' ' VAL . 0.5 OUTLIER 159.47 58.73 0.0 OUTLIER Pre-proline 0 N--CA 1.451 -0.387 0 CA-C-N 114.578 -1.192 . . . . 0.0 109.184 -179.322 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.509 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 0.9 OUTLIER -42.93 -52.02 5.01 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 123.65 2.9 . . . . 0.0 112.285 -179.769 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.529 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 1.0 OUTLIER -24.54 134.08 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.827 -179.431 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 38.9 t -138.81 151.05 46.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.984 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.566 HG13 ' N ' ' B' ' 402' ' ' VAL . 0.3 OUTLIER -109.72 142.94 20.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.037 -179.946 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.566 ' N ' HG13 ' B' ' 401' ' ' ILE . 1.6 t -108.26 160.83 7.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.6 -179.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.449 ' HB3' HG22 ' B' ' 388' ' ' VAL . 2.4 mt-10 -131.37 116.28 17.35 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.725 179.166 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.58 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -102.11 107.05 18.01 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.358 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.531 ' HA ' ' O ' ' B' ' 410' ' ' THR . 22.9 ptt180 -144.2 165.21 28.5 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.671 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.557 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 1.3 m -147.47 160.34 8.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.102 -179.036 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 65.84 2.71 13.09 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.905 -0.664 . . . . 0.0 113.414 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 7.3 t0 72.32 13.79 5.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.928 0.364 . . . . 0.0 111.16 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -157.43 14.63 0.3 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.243 -0.98 . . . . 0.0 113.488 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.531 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 2.5 m -133.83 121.4 21.74 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 117.057 0.429 . . . . 0.0 111.478 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 19.1 t -106.47 102.83 14.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.61 0.243 . . . . 0.0 110.41 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.54 ' CD1' ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -61.24 -25.33 67.0 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.838 -0.431 . . . . 0.0 109.838 179.422 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . 0.418 ' C ' ' SG ' ' B' ' 404' ' ' CYS . . . 164.61 -163.7 36.39 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.401 -0.904 . . . . 0.0 112.56 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.485 ' OG1' ' O ' ' B' ' 402' ' ' VAL . 3.5 t -160.34 159.75 31.58 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.982 0.42 . . . . 0.0 111.4 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.527 ' CA ' ' HD2' ' B' ' 426' ' ' ARG . . . -152.01 165.0 30.61 Favored Glycine 0 C--O 1.225 -0.443 0 C-N-CA 120.173 -1.013 . . . . 0.0 114.111 -179.144 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . 0.472 ' CG2' ' HB ' ' B' ' 401' ' ' ILE . 0.8 OUTLIER -152.76 144.91 15.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.396 -0.402 . . . . 0.0 111.412 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.529 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -155.98 177.16 33.2 Favored Glycine 0 C--N 1.329 0.187 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.133 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.527 ' N ' HD12 ' B' ' 422' ' ' ILE . 9.2 ptm180 -88.23 -43.26 11.72 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.848 0.324 . . . . 0.0 111.72 -179.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.586 ' O ' ' N ' ' B' ' 421' ' ' LYS . 0.2 OUTLIER -99.25 34.18 2.23 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 179.719 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.615 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 48.85 -45.04 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 178.509 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.635 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.7 OUTLIER -42.72 -56.04 3.34 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 -179.817 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.635 ' N ' ' HD3' ' B' ' 421' ' ' LYS . 0.1 OUTLIER -47.66 -24.94 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 CA-C-O 121.476 0.655 . . . . 0.0 109.513 178.32 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.615 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -76.48 -49.57 16.22 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.838 -1.074 . . . . 0.0 108.108 176.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . 0.492 ' O ' ' HB2' ' B' ' 427' ' ' ALA . . . -63.92 -52.57 44.02 Favored Glycine 0 N--CA 1.448 -0.519 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.247 179.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . 0.533 HG12 ' HG2' ' B' ' 421' ' ' LYS . 1.5 mm -64.65 -69.27 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.742 0.306 . . . . 0.0 110.531 179.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.542 ' HB3' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -47.37 -25.53 1.04 Allowed 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.278 -178.9 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.519 ' HB3' ' HB ' ' B' ' 402' ' ' VAL . . . -60.7 -59.09 5.93 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 107.675 -1.232 . . . . 0.0 107.675 176.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.53 ' O ' ' CD1' ' B' ' 432' ' ' LEU . . . -52.92 -48.73 67.03 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 177.23 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.512 ' HA ' HD22 ' B' ' 432' ' ' LEU . 1.9 tt0 -52.94 -17.84 1.64 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.732 178.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.474 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 10.4 m120 -85.25 -35.78 21.35 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.047 178.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.484 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -67.32 -36.31 81.2 Favored 'General case' 0 N--CA 1.461 0.116 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.733 -179.271 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.552 ' CB ' ' HG3' ' B' ' 373' ' ' GLN . 0.0 OUTLIER -94.01 12.2 27.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.805 179.58 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -87.04 -12.61 46.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.25 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -112.47 93.55 4.49 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.881 0.372 . . . . 0.0 111.4 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.556 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 8.9 ptmm? -57.37 -50.78 71.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.38 179.516 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.556 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -51.73 -45.39 63.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.637 179.896 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.491 ' O ' ' HB3' ' B' ' 440' ' ' PHE . 1.2 ttp -72.81 -46.69 51.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.113 0.482 . . . . 0.0 110.238 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.527 ' CD1' ' HA ' ' B' ' 432' ' ' LEU . 62.1 mt -53.98 -60.44 3.33 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.672 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . 0.415 ' O ' ' N ' ' B' ' 442' ' ' ALA . 22.4 t70 -54.43 -44.3 72.32 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.515 179.19 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.491 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -43.49 -45.07 6.29 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.609 -0.885 . . . . 0.0 108.609 179.424 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.423 ' O ' ' C ' ' B' ' 442' ' ' ALA . 51.7 m-85 -64.65 -43.17 94.5 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.331 179.039 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . 0.507 ' O ' ' N ' ' B' ' 445' ' ' ARG . . . -42.32 -61.79 1.11 Allowed 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 178.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -48.86 -45.7 41.26 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.19 -7.72 14.07 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.942 178.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.546 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -89.54 -44.18 10.29 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.374 179.441 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -82.37 -33.03 28.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.571 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.31 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.921 179.961 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 366' ' ' LEU . . . . . 0.434 HD21 ' ND2' ' B' ' 369' ' ' ASN . 14.9 tp . . . . . 0 C--O 1.233 0.19 0 CA-C-O 120.994 0.426 . . . . 0.0 111.219 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.466 ' O ' ' N ' ' B' ' 370' ' ' ALA . 21.5 t0 -58.29 -64.92 0.75 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.179 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.491 ' HA ' ' CE ' ' B' ' 371' ' ' LYS . 1.5 ttp -35.82 -44.05 0.33 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.615 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . 0.434 ' ND2' HD21 ' B' ' 366' ' ' LEU . 2.7 m-80 -60.99 -47.91 84.28 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.571 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.601 ' CB ' ' CB ' ' B' ' 428' ' ' ALA . . . -58.94 -70.59 0.14 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.626 179.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.491 ' CE ' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -36.22 -49.48 0.68 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.814 179.924 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.557 ' O ' ' CB ' ' B' ' 376' ' ' SER . 1.6 tmm_? -55.42 -38.44 68.98 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.508 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.541 ' HG3' ' CB ' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -65.58 -62.61 1.42 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.598 0.713 . . . . 0.0 110.425 179.175 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.477 HD11 ' OH ' ' B' ' 387' ' ' TYR . 1.0 OUTLIER -43.2 -70.77 0.1 Allowed 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -178.959 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -93.04 -20.83 20.16 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 -176.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.557 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.6 OUTLIER -94.45 1.6 55.76 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 119.91 -0.716 . . . . 0.0 111.1 -179.525 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.531 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 0.3 OUTLIER -134.68 -37.83 0.83 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.663 178.218 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.464 ' O ' ' C ' ' B' ' 379' ' ' GLY . 0.8 OUTLIER -127.76 -149.33 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.898 179.284 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.464 ' C ' ' O ' ' B' ' 378' ' ' ILE . . . 28.74 74.24 0.03 OUTLIER Glycine 0 C--N 1.332 0.338 0 C-N-CA 121.35 -0.452 . . . . 0.0 113.506 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.597 ' CD1' ' HD2' ' B' ' 445' ' ' ARG . 13.7 p90 -100.12 -50.76 3.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.697 0.248 . . . . 0.0 111.176 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . 0.516 ' CB ' ' O ' ' B' ' 380' ' ' TYR . . . 158.98 66.03 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.957 0.408 . . . . 0.0 111.079 179.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 382' ' ' SER . . . . . 0.548 ' HB2' ' CZ ' ' B' ' 380' ' ' TYR . 7.0 t -171.91 -72.18 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.795 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -49.22 -26.41 2.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.248 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . 0.462 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 7.1 tpt180 68.56 70.87 0.29 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.101 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.545 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 10.5 tt -89.18 121.98 32.02 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 179.118 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . 0.514 ' O ' ' O ' ' B' ' 405' ' ' ARG . 2.5 p-80 -141.57 145.87 35.61 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.401 0.62 . . . . 0.0 112.584 -179.025 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.477 ' OH ' HD11 ' B' ' 374' ' ' LEU . 28.7 m-85 -99.43 151.85 20.64 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.363 178.156 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . 0.546 HG21 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -129.82 120.35 49.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.345 179.114 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.9 m -87.06 119.11 26.93 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.257 -179.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.483 HG21 ' CG2' ' B' ' 401' ' ' ILE . 34.0 m -126.75 151.94 34.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.132 179.382 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.482 ' HB2' ' CG2' ' B' ' 401' ' ' ILE . 0.0 OUTLIER 73.81 111.72 0.07 Allowed 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -178.834 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.404 ' HA ' ' HD3' ' B' ' 393' ' ' PRO . 21.1 mttt -96.54 133.13 25.09 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 120.93 0.395 . . . . 0.0 111.281 -179.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.51 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 24.3 Cg_exo -62.22 166.04 13.64 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.631 2.22 . . . . 0.0 112.393 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 394' ' ' THR . . . . . 0.463 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 64.4 p -150.64 173.88 13.63 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.459 179.178 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . 0.436 ' C ' HG11 ' B' ' 396' ' ' VAL . . . -85.92 15.02 5.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.192 0.52 . . . . 0.0 110.58 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . 0.436 HG11 ' C ' ' B' ' 395' ' ' ALA . 22.8 m -146.79 16.73 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.272 178.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 167.86 68.29 0.01 OUTLIER Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.111 -179.391 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.524 ' HB2' ' O ' ' B' ' 418' ' ' ARG . 14.2 Cg_endo -55.4 -42.86 64.04 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 123.237 2.625 . . . . 0.0 112.311 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.54 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 6.0 m-20 -20.07 124.17 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.671 -179.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -133.79 141.57 47.53 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.361 178.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.516 HG13 ' N ' ' B' ' 402' ' ' VAL . 0.2 OUTLIER -114.05 138.46 43.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-O 121.269 0.557 . . . . 0.0 111.376 -179.058 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.526 ' CG2' ' O ' ' B' ' 423' ' ' ALA . 0.7 OUTLIER -105.11 166.7 3.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.433 -179.879 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.546 ' CB ' HG21 ' B' ' 388' ' ' VAL . 1.0 OUTLIER -133.8 112.59 11.46 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.045 0.45 . . . . 0.0 110.472 179.326 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.441 ' SG ' ' O ' ' B' ' 427' ' ' ALA . 0.0 OUTLIER -94.51 108.61 20.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.506 179.186 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.53 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.2 OUTLIER -150.3 169.28 21.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.151 0.501 . . . . 0.0 111.413 -179.439 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.545 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 1.2 m -144.59 145.21 21.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.775 -179.57 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 67.43 2.44 20.63 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.907 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . 0.479 ' HA ' ' HD3' ' B' ' 405' ' ' ARG . 16.5 t70 71.14 13.69 6.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.726 0.298 . . . . 0.0 111.066 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -137.11 -6.62 1.65 Allowed Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.395 -0.907 . . . . 0.0 113.6 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.53 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 95.3 m -127.03 119.71 27.28 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 117.15 0.475 . . . . 0.0 111.547 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . 0.476 ' HA ' ' HB2' ' B' ' 405' ' ' ARG . 41.5 t -102.89 97.09 5.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-O 120.752 0.31 . . . . 0.0 110.75 179.432 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.529 ' CD1' ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -56.32 -22.48 30.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.696 -179.971 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 164.71 -165.66 37.6 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.405 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.473 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -152.12 152.67 32.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.775 0.321 . . . . 0.0 110.732 -179.916 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.49 ' HA2' ' HG2' ' B' ' 426' ' ' ARG . . . -133.58 149.72 19.74 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 119.75 -1.214 . . . . 0.0 113.379 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . 0.499 ' CG1' ' O ' ' B' ' 416' ' ' VAL . 3.8 p -148.26 118.88 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.776 0.322 . . . . 0.0 110.544 179.293 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.54 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -133.29 164.66 24.22 Favored Glycine 0 C--O 1.226 -0.347 0 C-N-CA 120.842 -0.694 . . . . 0.0 111.395 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.524 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.5 OUTLIER -79.88 -48.1 14.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 117.465 0.632 . . . . 0.0 111.316 -179.953 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.624 ' O ' ' CG2' ' B' ' 420' ' ' ILE . 0.2 OUTLIER -74.41 -23.62 58.98 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.758 -0.201 . . . . 0.0 111.096 -179.651 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.624 ' CG2' ' O ' ' B' ' 419' ' ' ASN . 0.9 OUTLIER 102.87 -43.61 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 C-N-CA 124.299 1.04 . . . . 0.0 109.946 -178.374 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.613 ' CD ' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -49.92 -54.59 18.76 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.032 -1.47 . . . . 0.0 107.032 178.605 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.613 ' N ' ' CD ' ' B' ' 421' ' ' LYS . 0.1 OUTLIER -53.21 -14.48 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.515 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.89 177.935 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.546 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -84.06 -49.14 9.19 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 107.22 -1.4 . . . . 0.0 107.22 176.487 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . 0.403 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -60.88 -54.17 39.15 Favored Glycine 0 C--N 1.336 0.534 0 N-CA-C 109.883 -1.287 . . . . 0.0 109.883 177.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . 0.457 ' CD1' ' OD2' ' B' ' 367' ' ' ASP . 8.9 mm -53.96 -68.28 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 177.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.593 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 2.6 tpt180 -39.93 -28.56 0.05 Allowed 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.101 179.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.441 ' O ' ' SG ' ' B' ' 404' ' ' CYS . . . -64.68 -55.1 22.22 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 177.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.601 ' CB ' ' CB ' ' B' ' 370' ' ' ALA . . . -59.84 -55.01 39.47 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.477 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.07 -11.92 0.53 Allowed 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.794 179.285 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.502 ' ND2' ' O ' ' B' ' 426' ' ' ARG . 1.4 m-80 -92.09 -32.04 15.31 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 177.668 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.426 ' O ' ' HE2' ' B' ' 437' ' ' MET . . . -71.93 -44.9 62.88 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.027 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.541 ' CB ' ' HG3' ' B' ' 373' ' ' GLN . 0.4 OUTLIER -85.1 11.1 10.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.015 -179.948 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . 0.523 ' HG2' ' O ' ' B' ' 433' ' ' ARG . 0.0 OUTLIER -80.27 -0.1 35.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.372 179.816 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . 0.464 ' O ' ' HG ' ' B' ' 438' ' ' LEU . 31.3 t0 -130.09 93.17 3.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.747 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.58 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -58.24 -39.7 79.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.867 -179.832 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.58 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 9.8 mtpt -57.27 -41.64 80.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.767 0.318 . . . . 0.0 110.414 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.477 ' CE ' ' HG ' ' B' ' 412' ' ' LEU . 33.7 ttp -74.67 -48.43 26.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.169 0.509 . . . . 0.0 109.811 179.059 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.522 ' CD1' ' HA ' ' B' ' 432' ' ' LEU . 94.1 mt -53.94 -64.42 0.83 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.192 178.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -51.95 -45.25 64.29 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.245 -0.888 . . . . 0.0 109.93 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.564 ' CE1' ' HG3' ' B' ' 444' ' ' GLN . 0.1 OUTLIER -45.2 -38.59 5.48 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 179.561 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.548 ' CE1' ' CE2' ' B' ' 440' ' ' PHE . 25.6 m-85 -74.44 -39.64 62.44 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.061 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -52.15 -60.52 3.11 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 178.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 8.7 tttp -50.7 -44.4 57.98 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.206 -0.665 . . . . 0.0 109.206 178.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . 0.564 ' HG3' ' CE1' ' B' ' 440' ' ' PHE . 0.0 OUTLIER -55.18 -50.75 68.57 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.028 178.787 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.597 ' HD2' ' CD1' ' B' ' 380' ' ' TYR . 7.8 mmp_? -51.69 -36.65 47.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.793 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -75.19 -41.14 58.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.956 0.408 . . . . 0.0 110.442 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.288 179.905 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 366' ' ' LEU . . . . . 0.462 ' HB3' ' HB2' ' B' ' 369' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.181 0 CA-C-O 120.886 0.374 . . . . 0.0 111.223 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.518 ' CB ' HG13 ' B' ' 425' ' ' ILE . 0.0 OUTLIER -55.42 -71.08 0.09 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.601 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.467 ' HE2' ' OD1' ' B' ' 369' ' ' ASN . 3.3 tmm? -35.72 -43.79 0.3 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.999 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . 0.467 ' OD1' ' HE2' ' B' ' 368' ' ' MET . 87.1 m-20 -65.31 -42.9 92.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.896 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.548 ' O ' ' N ' ' B' ' 373' ' ' GLN . . . -62.76 -71.94 0.15 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.448 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.437 ' HD3' ' O ' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -35.82 -49.45 0.61 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.968 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.572 ' O ' ' CB ' ' B' ' 376' ' ' SER . 3.5 tmm_? -58.39 -37.03 74.45 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.924 0.393 . . . . 0.0 110.71 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.548 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -62.34 -48.61 79.05 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.219 0.533 . . . . 0.0 110.973 179.259 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.562 ' O ' ' N ' ' B' ' 379' ' ' GLY . 0.4 OUTLIER -62.42 -69.06 0.28 Allowed 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -178.127 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -70.83 -40.2 72.56 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -177.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.572 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.5 OUTLIER -71.9 -51.63 21.24 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.227 0.455 . . . . 0.0 112.227 -178.642 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.482 ' CD2' ' NH1' ' B' ' 372' ' ' ARG . 2.3 mm? -89.32 -23.25 22.31 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 114.733 1.383 . . . . 0.0 114.733 -176.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.522 ' O ' ' N ' ' B' ' 380' ' ' TYR . 20.8 mm -127.82 -74.77 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 119.219 0.918 . . . . 0.0 113.429 -178.018 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.562 ' N ' ' O ' ' B' ' 374' ' ' LEU . . . -51.61 80.43 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.176 0 CA-C-N 116.188 -0.46 . . . . 0.0 113.433 -178.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.637 ' CE1' ' O ' ' B' ' 382' ' ' SER . 14.5 p90 -102.05 173.18 6.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.757 0.313 . . . . 0.0 111.117 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . 0.442 ' C ' ' O ' ' B' ' 380' ' ' TYR . . . -28.07 -43.03 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.193 -179.281 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 382' ' ' SER . . . . . 0.637 ' O ' ' CE1' ' B' ' 380' ' ' TYR . 0.5 OUTLIER -114.39 132.34 56.26 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.839 -179.945 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.582 ' CB ' ' O ' ' B' ' 382' ' ' SER . 0.1 OUTLIER 151.31 -49.74 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.936 0.398 . . . . 0.0 110.479 -179.871 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . 0.527 ' N ' HD11 ' B' ' 383' ' ' LEU . 0.0 OUTLIER 69.88 73.75 0.23 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.064 178.708 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.58 ' HB2' ' CD1' ' B' ' 383' ' ' LEU . 6.0 tt -102.71 128.8 49.27 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 179.107 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . 0.478 ' O ' ' O ' ' B' ' 405' ' ' ARG . 14.9 p-80 -141.32 144.96 34.88 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.48 0.657 . . . . 0.0 112.761 -179.038 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.512 ' OH ' ' CD1' ' B' ' 374' ' ' LEU . 27.4 m-85 -103.06 145.93 29.15 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.748 178.633 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . 0.45 HG22 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -129.08 122.23 55.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.128 179.211 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.7 m -85.5 122.52 29.75 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.555 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.555 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 35.7 m -130.25 154.28 40.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.549 -179.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.555 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 9.0 tptt 95.07 23.01 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.326 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.532 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER 3.62 114.11 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.696 0 O-C-N 123.979 0.799 . . . . 0.0 112.192 179.931 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.476 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 34.5 Cg_exo -55.2 163.64 4.41 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.525 2.15 . . . . 0.0 113.226 -179.17 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 394' ' ' THR . . . . . 0.473 ' CG2' ' OD1' ' B' ' 397' ' ' ASP . 0.1 OUTLIER -131.33 177.22 7.64 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.706 -1.133 . . . . 0.0 111.738 -179.288 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -102.08 18.0 21.87 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.565 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . 0.496 ' O ' ' HB3' ' B' ' 397' ' ' ASP . 10.1 m -137.4 6.57 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.984 178.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . 0.496 ' HB3' ' O ' ' B' ' 396' ' ' VAL . 17.8 p-10 172.79 54.17 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.384 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.476 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 93.1 Cg_exo -33.34 -29.18 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.613 2.875 . . . . 0.0 113.566 -179.161 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.547 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 1.1 p-10 -31.65 125.41 0.24 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.189 0.519 . . . . 0.0 111.854 -178.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 400' ' ' SER . . . . . 0.46 ' HB2' ' HG3' ' B' ' 393' ' ' PRO . 29.1 t -133.92 157.01 47.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.914 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.545 ' CG1' ' O ' ' B' ' 415' ' ' GLY . 4.6 tt -114.85 151.58 16.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.14 0.495 . . . . 0.0 111.037 -179.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.437 ' O ' HG21 ' B' ' 414' ' ' THR . 0.4 OUTLIER -116.14 158.59 16.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.14 -178.971 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.45 ' CB ' HG22 ' B' ' 388' ' ' VAL . 3.6 mm-40 -122.79 118.37 27.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.884 179.012 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.512 ' O ' ' N ' ' B' ' 412' ' ' LEU . 8.9 t -96.77 100.04 11.6 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 179.056 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.624 ' HA ' ' O ' ' B' ' 410' ' ' THR . 13.1 ttp180 -140.35 162.73 34.59 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 121.033 0.444 . . . . 0.0 111.53 -179.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.54 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 2.0 m -146.5 -178.54 0.71 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.44 -179.328 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 58.86 -101.48 0.22 Allowed Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.914 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -156.95 18.37 0.31 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.874 0.368 . . . . 0.0 110.965 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 165.03 37.35 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.937 -0.649 . . . . 0.0 111.942 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.624 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 17.4 m -122.96 114.73 20.82 Favored 'General case' 0 C--O 1.217 -0.644 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 47.1 t -107.33 107.79 23.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.581 0.229 . . . . 0.0 111.047 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.531 ' CD2' HG11 ' B' ' 406' ' ' VAL . 0.6 OUTLIER -66.91 -27.87 67.85 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 179.324 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . 0.498 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 167.26 -168.19 40.3 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.211 -0.995 . . . . 0.0 113.004 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.459 ' C ' ' OD1' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -145.58 155.97 43.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.697 0.284 . . . . 0.0 111.211 -179.364 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.545 ' O ' ' CG1' ' B' ' 401' ' ' ILE . . . -148.3 151.89 24.03 Favored Glycine 0 C--O 1.223 -0.564 0 C-N-CA 120.227 -0.987 . . . . 0.0 113.22 -179.477 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . 0.407 ' HB ' HG13 ' B' ' 401' ' ' ILE . 3.5 p -139.12 148.86 23.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.731 0.301 . . . . 0.0 110.978 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.547 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -160.53 152.59 23.35 Favored Glycine 0 C--O 1.228 -0.24 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.16 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.529 ' N ' HD13 ' B' ' 422' ' ' ILE . 0.0 OUTLIER -68.81 -44.5 73.4 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.378 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.549 ' O ' ' N ' ' B' ' 421' ' ' LYS . 0.3 OUTLIER -98.05 32.08 2.52 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.185 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.606 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.4 OUTLIER 51.55 -47.43 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 178.59 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.614 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -44.91 -54.79 6.09 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -179.577 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.615 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.1 OUTLIER -50.39 -19.34 0.71 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.527 0 N-CA-C 109.9 -0.408 . . . . 0.0 109.9 178.486 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.606 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -83.23 -48.37 10.55 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 177.124 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -59.78 -52.36 53.42 Favored Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 177.666 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . 0.518 HG13 ' CB ' ' B' ' 367' ' ' ASP . 0.5 OUTLIER -57.61 -67.17 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 177.329 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.615 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 10.8 tpt180 -39.81 -30.19 0.08 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.096 178.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.487 ' HA ' ' OD1' ' B' ' 430' ' ' ASN . . . -60.71 -61.42 2.6 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.508 ' CB ' HD11 ' B' ' 374' ' ' LEU . . . -53.23 -49.84 66.0 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 177.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.519 ' O ' ' CD2' ' B' ' 432' ' ' LEU . 1.4 tt0 -47.51 -24.54 0.87 Allowed 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.431 178.639 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.498 ' HB3' ' HA3' ' B' ' 413' ' ' GLY . 14.2 m120 -81.71 -34.63 30.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.65 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.45 ' O ' HD21 ' B' ' 438' ' ' LEU . . . -69.84 -42.28 73.79 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.532 ' HA ' ' CD1' ' B' ' 438' ' ' LEU . 0.0 OUTLIER -83.66 9.62 11.2 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.889 -0.324 . . . . 0.0 111.408 -179.507 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . 0.426 ' HD3' ' O ' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -88.68 -9.75 50.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.163 -179.587 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . 0.48 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 76.7 m-20 -108.91 83.51 1.77 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.239 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.543 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 4.6 ptmm? -50.77 -53.38 32.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.027 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.543 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 10.0 mtpp -52.48 -43.98 65.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.736 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.48 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 14.3 tmm? -70.08 -50.52 40.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.964 0.412 . . . . 0.0 110.252 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.532 ' CD1' ' HA ' ' B' ' 432' ' ' LEU . 85.6 mt -52.77 -61.98 1.94 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.398 179.326 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -56.42 -44.13 80.08 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.032 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.453 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -42.29 -44.73 3.95 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.908 179.641 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.448 ' O ' ' HG2' ' B' ' 445' ' ' ARG . 49.9 m-85 -67.94 -44.49 76.71 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.62 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . 0.409 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -44.5 -60.54 1.92 Allowed 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 178.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 11.2 ttmt -47.76 -38.93 16.57 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.652 -0.703 . . . . 0.0 109.219 178.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . 0.607 ' HG3' ' N ' ' B' ' 445' ' ' ARG . 0.0 OUTLIER -61.3 -51.32 69.38 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 178.512 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.611 ' CD ' ' CD1' ' B' ' 380' ' ' TYR . 0.3 OUTLIER -44.11 -43.95 7.26 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.993 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -80.59 -36.21 33.13 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.189 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.295 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.942 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 366' ' ' LEU . . . . . 0.477 HD11 ' OD1' ' B' ' 369' ' ' ASN . 6.1 tp . . . . . 0 CA--C 1.523 -0.078 0 CA-C-O 121.369 0.604 . . . . 0.0 110.79 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.544 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.2 OUTLIER -44.75 -75.14 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.99 179.396 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.452 ' HE2' ' CG ' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -36.15 -44.2 0.38 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.666 179.779 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . 0.477 ' OD1' HD11 ' B' ' 366' ' ' LEU . 7.7 m120 -66.49 -38.36 87.11 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.921 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.546 ' O ' ' N ' ' B' ' 373' ' ' GLN . . . -61.31 -70.45 0.19 Allowed 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.831 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.426 ' C ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -39.07 -42.17 0.88 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.061 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.559 ' O ' ' CB ' ' B' ' 376' ' ' SER . 3.0 tmt_? -53.49 -43.28 68.1 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.73 179.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.546 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -64.43 -60.93 2.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.485 179.212 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.535 HD11 ' CB ' ' B' ' 428' ' ' ALA . 0.7 OUTLIER -45.8 -74.4 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 -178.474 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -95.56 -4.7 44.21 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -176.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.559 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -108.84 1.15 20.7 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.044 -0.662 . . . . 0.0 110.337 179.017 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 0.2 OUTLIER -133.88 -40.16 0.86 Allowed 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 178.215 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.463 ' C ' ' O ' ' B' ' 374' ' ' LEU . 2.1 mm -129.37 -144.88 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.609 179.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.465 ' HA2' HD22 ' B' ' 383' ' ' LEU . . . 40.65 66.61 0.83 Allowed Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.993 -0.622 . . . . 0.0 113.701 179.026 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.585 ' CZ ' ' HB3' ' B' ' 383' ' ' LEU . 30.9 p90 -77.12 -4.03 42.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.802 0.301 . . . . 0.0 110.569 179.04 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . 0.55 ' CB ' ' O ' ' B' ' 380' ' ' TYR . . . 95.15 -38.53 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 178.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 382' ' ' SER . . . . . 0.448 ' HB3' ' CE2' ' B' ' 380' ' ' TYR . 11.1 t -86.59 24.9 1.33 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.172 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.585 ' HB3' ' CZ ' ' B' ' 380' ' ' TYR . 0.4 OUTLIER -114.31 -5.8 12.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.699 0.285 . . . . 0.0 111.064 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . 0.432 ' O ' HG13 ' B' ' 406' ' ' VAL . 14.5 tpp180 63.68 59.14 1.2 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.994 0.426 . . . . 0.0 110.693 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.568 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 7.8 tt -114.43 133.11 55.97 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.907 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 6.2 p-80 -158.85 160.73 36.51 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.631 0.729 . . . . 0.0 112.785 -179.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.522 ' CE2' ' HB3' ' B' ' 404' ' ' CYS . 8.0 m-85 -108.09 145.72 33.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.624 -1.171 . . . . 0.0 110.511 178.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.86 125.56 65.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.536 179.108 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.6 m -86.14 123.87 31.91 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.499 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.513 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 19.6 m -129.89 156.97 42.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.01 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.513 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 86.49 19.9 0.08 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.036 179.868 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.509 ' C ' ' O ' ' B' ' 391' ' ' LYS . 1.3 mmmt -2.76 122.66 0.0 OUTLIER Pre-proline 0 N--CA 1.471 0.616 0 O-C-N 124.194 0.934 . . . . 0.0 112.551 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.51 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 12.4 Cg_exo -66.24 157.48 59.76 Favored 'Trans proline' 0 N--CA 1.464 -0.24 0 C-N-CA 122.695 2.263 . . . . 0.0 113.282 -179.577 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 394' ' ' THR . . . . . 0.473 ' O ' ' HD3' ' B' ' 398' ' ' PRO . 0.3 OUTLIER -148.64 166.34 28.63 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.798 -1.092 . . . . 0.0 111.472 -179.764 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -82.69 10.13 8.16 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-O 121.089 0.471 . . . . 0.0 110.812 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 27.2 m -132.67 15.04 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 165.73 57.46 0.0 OUTLIER Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 114.581 -1.19 . . . . 0.0 109.335 -179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.51 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 1.0 OUTLIER -42.95 -54.64 3.24 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 123.483 2.789 . . . . 0.0 111.715 179.981 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.516 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 6.7 m120 -19.54 130.51 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.837 -1.074 . . . . 0.0 112.002 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -140.25 150.49 44.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.898 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.541 HG13 ' N ' ' B' ' 402' ' ' VAL . 0.5 OUTLIER -115.44 143.98 24.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.985 -179.714 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.541 ' N ' HG13 ' B' ' 401' ' ' ILE . 1.5 t -108.65 159.62 7.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.949 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -134.03 123.35 24.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.442 179.568 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.527 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.1 OUTLIER -111.08 113.04 25.27 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 179.27 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.582 ' HA ' ' O ' ' B' ' 410' ' ' THR . 3.1 ptt180 -141.26 171.73 13.67 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 123.389 0.431 . . . . 0.0 111.675 -179.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.568 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -139.32 166.7 21.18 Favored 'Isoleucine or valine' 0 C--O 1.239 0.536 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.383 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . 0.592 ' O ' ' CB ' ' B' ' 408' ' ' ASP . . . -45.26 103.3 0.05 OUTLIER Glycine 0 C--N 1.338 0.686 0 CA-C-N 114.879 -1.055 . . . . 0.0 113.335 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . 0.592 ' CB ' ' O ' ' B' ' 407' ' ' GLY . 3.8 t70 137.21 -9.14 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 123.796 0.838 . . . . 0.0 109.745 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 88.81 19.04 53.14 Favored Glycine 0 N--CA 1.442 -0.904 0 N-CA-C 110.876 -0.89 . . . . 0.0 110.876 -179.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.582 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 34.7 m -82.49 125.49 31.16 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . 0.467 HG13 ' O ' ' B' ' 404' ' ' CYS . 26.8 t -103.09 110.79 30.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 120.678 0.275 . . . . 0.0 110.301 179.535 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.527 ' N ' ' O ' ' B' ' 404' ' ' CYS . 0.3 OUTLIER -64.07 -28.91 70.11 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.286 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 167.58 -169.03 40.95 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.162 -1.018 . . . . 0.0 112.749 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.485 ' N ' ' OD1' ' B' ' 430' ' ' ASN . 3.5 t -156.0 148.76 24.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.909 0.385 . . . . 0.0 110.949 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.517 ' CA ' ' CG ' ' B' ' 426' ' ' ARG . . . -131.6 162.42 23.75 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.261 -0.971 . . . . 0.0 113.279 -179.569 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . 0.451 ' HB ' HD13 ' B' ' 401' ' ' ILE . 3.5 p -142.57 150.4 18.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.689 -0.256 . . . . 0.0 110.731 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.554 ' HA3' ' CD1' ' B' ' 422' ' ' ILE . . . -172.57 150.0 12.18 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.165 -1.017 . . . . 0.0 113.008 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.519 ' N ' HD13 ' B' ' 422' ' ' ILE . 0.0 OUTLIER -69.73 -43.28 72.64 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.822 0.344 . . . . 0.0 111.894 -179.701 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.571 ' O ' ' N ' ' B' ' 421' ' ' LYS . 6.0 t30 -97.06 29.19 3.21 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.608 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 51.38 -45.43 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 178.401 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.632 ' CD ' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -43.95 -54.36 5.43 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 -179.92 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.632 ' N ' ' CD ' ' B' ' 421' ' ' LYS . 0.0 OUTLIER -48.07 -21.04 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.057 178.551 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.608 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -83.57 -47.71 11.02 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 177.35 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . 0.478 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -59.63 -52.23 54.28 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 110.136 -1.186 . . . . 0.0 110.136 177.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . 0.462 ' CD1' ' HB3' ' B' ' 367' ' ' ASP . 4.8 mm -58.46 -67.15 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 177.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.579 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 24.2 tpt180 -38.01 -31.31 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.186 178.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.492 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -62.93 -57.59 10.27 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 178.434 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.54 ' O ' ' CD2' ' B' ' 432' ' ' LEU . . . -55.76 -52.39 64.12 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.67 178.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.402 ' OE1' HG23 ' B' ' 425' ' ' ILE . 0.7 OUTLIER -56.63 -18.25 11.43 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.706 179.369 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.9 OUTLIER -79.85 -40.8 27.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.407 178.862 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.468 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -67.46 -35.03 78.39 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.376 -179.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.54 ' CD2' ' O ' ' B' ' 428' ' ' ALA . 0.2 OUTLIER -86.98 10.96 14.77 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.682 179.786 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -85.0 -9.07 58.42 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.079 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . 0.525 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 62.7 m-20 -115.65 80.01 1.38 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.021 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.55 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 7.7 ptpt -48.92 -53.03 21.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.846 0.355 . . . . 0.0 110.278 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.55 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.2 OUTLIER -53.19 -42.42 66.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.551 179.809 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.525 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 0.8 OUTLIER -71.12 -45.77 62.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.24 0.543 . . . . 0.0 109.598 179.085 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . . . . . . . . . 76.9 mt -52.64 -59.88 3.93 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.461 178.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -56.6 -44.26 80.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.007 -0.997 . . . . 0.0 109.718 178.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.524 ' C ' ' CD1' ' B' ' 440' ' ' PHE . 0.2 OUTLIER -43.38 -43.95 5.41 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.564 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.574 ' CE1' HD12 ' B' ' 383' ' ' LEU . 49.7 m-85 -66.37 -46.12 77.78 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.47 179.226 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . 0.441 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -42.27 -60.64 1.4 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 178.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -49.09 -47.43 45.16 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . 0.503 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -52.75 -58.78 5.75 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.485 179.157 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.554 ' HG2' ' CD1' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -42.73 -38.78 2.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.68 179.504 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -74.63 -36.8 62.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.637 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 447' ' ' ALA . . . . . 0.414 ' N ' ' O ' ' B' ' 444' ' ' GLN . . . . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.446 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 366' ' ' LEU . . . . . 0.559 HD13 ' ND2' ' B' ' 369' ' ' ASN . 2.2 tp . . . . . 0 CA--C 1.527 0.091 0 CA-C-O 121.374 0.606 . . . . 0.0 111.26 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.516 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -38.27 -72.7 0.06 Allowed 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.625 179.015 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.527 ' HE2' ' ND2' ' B' ' 369' ' ' ASN . 0.3 OUTLIER -37.66 -36.88 0.19 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.052 179.813 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . 0.559 ' ND2' HD13 ' B' ' 366' ' ' LEU . 7.7 m-80 -63.79 -43.29 96.79 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.597 ' O ' ' N ' ' B' ' 373' ' ' GLN . . . -60.55 -68.68 0.28 Allowed 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.514 ' HE2' ' N ' ' B' ' 368' ' ' MET . 0.1 OUTLIER -34.03 -49.39 0.35 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.711 -179.844 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.546 ' O ' ' CB ' ' B' ' 376' ' ' SER . 5.0 tmm_? -60.65 -36.59 79.05 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.922 179.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.597 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -63.9 -49.81 71.21 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.88 179.581 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.458 HD11 ' OH ' ' B' ' 387' ' ' TYR . 0.4 OUTLIER -58.51 -67.04 0.4 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.607 -178.843 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . 0.502 ' O ' ' HA3' ' B' ' 379' ' ' GLY . 3.3 m-85 -71.51 -50.79 27.97 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -177.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.546 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.5 OUTLIER -66.57 -53.97 28.73 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -178.789 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.472 ' HG ' ' OE1' ' B' ' 373' ' ' GLN . 0.1 OUTLIER -76.06 -38.27 57.3 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 -178.466 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.471 HG13 HD23 ' B' ' 438' ' ' LEU . 4.8 mm -131.79 38.84 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.064 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.502 ' HA3' ' O ' ' B' ' 375' ' ' TYR . . . -121.99 63.15 0.52 Allowed Glycine 0 N--CA 1.453 -0.181 0 C-N-CA 120.372 -0.918 . . . . 0.0 112.552 179.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.571 ' O ' ' CB ' ' B' ' 381' ' ' ALA . 3.0 p90 -86.05 -3.23 58.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.527 0.204 . . . . 0.0 111.1 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . 0.589 ' O ' ' N ' ' B' ' 383' ' ' LEU . . . 99.05 -171.05 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.592 -179.277 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 382' ' ' SER . . . . . 0.443 ' C ' ' O ' ' B' ' 381' ' ' ALA . 10.4 m 26.2 35.68 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.542 -0.754 . . . . 0.0 112.038 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.589 ' N ' ' O ' ' B' ' 381' ' ' ALA . 0.8 OUTLIER -103.21 -24.88 13.53 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.836 0.35 . . . . 0.0 110.914 -179.398 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . 0.485 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 3.5 tpt85 61.05 51.74 4.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.227 179.657 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.525 ' HG ' ' CG1' ' B' ' 406' ' ' VAL . 7.8 tt -94.87 123.99 38.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.067 179.229 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . 0.496 ' O ' ' O ' ' B' ' 405' ' ' ARG . 2.2 p-80 -148.34 151.67 35.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.855 0.836 . . . . 0.0 113.179 -178.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.509 ' CZ ' ' SG ' ' B' ' 404' ' ' CYS . 8.1 m-85 -105.45 156.66 17.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.724 -1.125 . . . . 0.0 110.11 178.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . 0.54 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -133.98 124.52 46.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.236 0.541 . . . . 0.0 110.847 179.588 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -85.21 119.93 26.14 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.439 -179.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.52 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 32.8 m -130.86 151.91 36.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.365 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.53 ' O ' ' C ' ' B' ' 392' ' ' LYS . 0.1 OUTLIER 85.2 16.02 0.16 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.335 179.638 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.53 ' C ' ' O ' ' B' ' 391' ' ' LYS . 22.3 mmtt -3.51 121.63 0.0 OUTLIER Pre-proline 0 N--CA 1.472 0.674 0 O-C-N 123.987 0.805 . . . . 0.0 112.348 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.501 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 25.5 Cg_exo -56.61 162.62 8.07 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.412 2.075 . . . . 0.0 112.788 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 394' ' ' THR . . . . . 0.465 ' O ' ' HD3' ' B' ' 398' ' ' PRO . 1.1 p -156.5 168.57 26.95 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.399 -0.818 . . . . 0.0 111.73 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -81.24 8.03 9.93 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.103 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . 0.456 ' O ' ' HB2' ' B' ' 397' ' ' ASP . 24.2 m -132.11 14.83 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.448 0.642 . . . . 0.0 109.578 178.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . 0.456 ' HB2' ' O ' ' B' ' 396' ' ' VAL . 0.1 OUTLIER 166.03 58.33 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.765 -179.644 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.501 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 5.2 Cg_exo -39.86 -52.69 2.63 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 123.525 2.817 . . . . 0.0 112.281 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.525 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.8 OUTLIER -25.11 132.14 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.323 -0.853 . . . . 0.0 112.113 -178.84 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 400' ' ' SER . . . . . 0.469 ' HB2' ' HG3' ' B' ' 393' ' ' PRO . 18.4 t -135.86 144.52 45.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.951 179.565 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.522 HG13 ' N ' ' B' ' 402' ' ' VAL . 0.2 OUTLIER -112.27 139.46 36.85 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 CA-C-O 120.949 0.404 . . . . 0.0 110.662 -179.861 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.522 ' N ' HG13 ' B' ' 401' ' ' ILE . 0.7 OUTLIER -100.01 161.23 3.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.773 -179.669 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.54 ' CB ' HG23 ' B' ' 388' ' ' VAL . 2.8 mm-40 -128.13 109.05 11.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.528 178.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.509 ' SG ' ' CZ ' ' B' ' 387' ' ' TYR . 10.6 t -97.62 108.24 20.92 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.583 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.553 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -153.59 173.46 15.73 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.141 0.496 . . . . 0.0 111.532 -179.321 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.525 ' CG1' ' HG ' ' B' ' 385' ' ' LEU . 1.4 m -150.85 -175.84 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.989 -179.282 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . 0.409 ' N ' HG21 ' B' ' 406' ' ' VAL . . . 55.74 -103.85 0.27 Allowed Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.379 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -157.87 19.33 0.26 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.944 0.402 . . . . 0.0 110.883 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 173.05 25.52 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.878 -0.677 . . . . 0.0 113.145 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.553 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 24.4 m -113.17 110.3 20.19 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 117.102 0.451 . . . . 0.0 110.607 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . 0.433 ' HA ' ' HB3' ' B' ' 405' ' ' ARG . 10.5 t -102.33 95.48 3.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.678 0.275 . . . . 0.0 111.346 -179.712 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.492 ' CD1' ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -56.28 -22.34 29.54 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.933 0.397 . . . . 0.0 110.009 179.466 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 164.68 -167.38 38.45 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.485 -0.864 . . . . 0.0 112.729 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.437 ' C ' ' OD1' ' B' ' 430' ' ' ASN . 0.1 OUTLIER -153.53 148.14 26.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.887 0.375 . . . . 0.0 110.872 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.494 ' O ' HD13 ' B' ' 401' ' ' ILE . . . -130.91 151.24 19.55 Favored Glycine 0 C--O 1.225 -0.449 0 C-N-CA 120.187 -1.006 . . . . 0.0 113.149 -179.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . 0.416 ' CG2' ' HB ' ' B' ' 401' ' ' ILE . 1.9 p -152.11 126.13 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.134 0.492 . . . . 0.0 111.554 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.525 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -138.24 170.1 23.98 Favored Glycine 0 N--CA 1.449 -0.464 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.834 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.51 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 0.6 OUTLIER -83.88 -47.42 11.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.977 0.388 . . . . 0.0 111.572 -179.69 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.638 ' O ' ' CG2' ' B' ' 420' ' ' ILE . 0.2 OUTLIER -80.17 -25.77 39.63 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.53 -179.579 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.638 ' CG2' ' O ' ' B' ' 419' ' ' ASN . 1.5 pp 112.23 -43.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 124.703 1.201 . . . . 0.0 110.138 -179.138 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.48 ' C ' ' H ' ' B' ' 423' ' ' ALA . 0.3 OUTLIER -45.8 -59.15 2.96 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 179.382 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.616 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.0 OUTLIER -47.63 -16.75 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.473 0 CA-C-N 114.992 -1.003 . . . . 0.0 109.862 177.685 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.557 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -87.2 -49.89 6.98 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 177.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.12 -44.36 94.81 Favored Glycine 0 C--N 1.338 0.68 0 C-N-CA 119.776 -1.202 . . . . 0.0 110.503 178.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . 0.545 ' CD1' ' N ' ' B' ' 425' ' ' ILE . 1.1 mm -68.46 -65.03 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.277 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.616 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 12.9 tpt180 -40.17 -28.51 0.06 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.026 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.491 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -75.19 -52.96 9.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.714 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.551 ' CB ' ' HB3' ' B' ' 370' ' ' ALA . . . -50.32 -50.5 50.68 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.411 0.624 . . . . 0.0 109.439 178.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.589 ' O ' ' N ' ' B' ' 432' ' ' LEU . 57.8 mt-10 -60.19 -60.21 4.18 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 177.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.524 ' C ' ' O ' ' B' ' 429' ' ' GLU . 3.8 m120 -24.41 -45.73 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.308 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.517 ' N ' ' O ' ' B' ' 429' ' ' GLU . . . -70.63 -54.46 11.89 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-O 121.129 0.49 . . . . 0.0 110.103 178.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.6 ' C ' ' CD2' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -73.7 3.12 6.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.198 178.956 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . 0.498 ' N ' ' O ' ' B' ' 429' ' ' GLU . 0.8 OUTLIER -87.21 -8.48 56.8 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.851 -179.104 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . 0.482 ' OD2' ' CB ' ' B' ' 437' ' ' MET . 48.0 t0 -115.84 93.05 4.09 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.784 0.326 . . . . 0.0 110.905 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.589 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 0.6 OUTLIER -61.03 -42.2 98.02 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.178 -0.464 . . . . 0.0 109.875 179.54 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.589 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 25.4 mttt -54.61 -48.28 72.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.387 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.482 ' CB ' ' OD2' ' B' ' 434' ' ' ASP . 13.1 tmm? -71.46 -50.14 34.55 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.285 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.535 ' CD1' ' HA ' ' B' ' 432' ' ' LEU . 74.9 mt -50.81 -60.87 2.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.43 0.633 . . . . 0.0 110.123 179.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . 0.412 ' O ' ' N ' ' B' ' 442' ' ' ALA . 11.3 t70 -59.09 -41.5 88.22 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.321 178.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.529 ' C ' ' CD1' ' B' ' 440' ' ' PHE . 0.0 OUTLIER -44.04 -46.56 8.5 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 179.49 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.513 ' O ' ' CG ' ' B' ' 444' ' ' GLN . 55.9 m-85 -66.96 -39.78 87.32 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.22 179.042 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . 0.412 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -46.98 -60.16 2.63 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 177.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -47.32 -40.63 17.51 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.121 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . 0.644 ' HG3' ' N ' ' B' ' 445' ' ' ARG . 0.0 OUTLIER -58.23 -52.15 66.78 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.678 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.644 ' N ' ' HG3' ' B' ' 444' ' ' GLN . 0.4 OUTLIER -45.74 -42.18 11.58 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.744 179.813 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -71.74 -38.29 70.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.09 0.472 . . . . 0.0 110.209 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.047 179.937 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 366' ' ' LEU . . . . . 0.463 HD23 ' ND2' ' B' ' 369' ' ' ASN . 1.2 mp . . . . . 0 CA--C 1.522 -0.098 0 CA-C-O 121.056 0.455 . . . . 0.0 111.508 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.5 ' HB3' ' CG1' ' B' ' 425' ' ' ILE . 0.3 OUTLIER -54.75 -71.23 0.08 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.213 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.447 ' C ' ' O ' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -32.39 -49.36 0.2 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.931 179.805 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . 0.463 ' ND2' HD23 ' B' ' 366' ' ' LEU . 57.2 m-20 -62.14 -47.42 84.64 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.685 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.571 ' CB ' ' CB ' ' B' ' 428' ' ' ALA . . . -61.64 -71.14 0.16 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.656 0.265 . . . . 0.0 110.303 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.455 ' HD2' ' HB2' ' B' ' 367' ' ' ASP . 0.2 OUTLIER -33.09 -46.46 0.16 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.038 179.849 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.554 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.0 OUTLIER -66.69 -38.31 86.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.648 -179.484 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.528 ' N ' ' O ' ' B' ' 370' ' ' ALA . 3.8 tm0? -61.63 -59.02 5.84 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.352 0.596 . . . . 0.0 110.639 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.475 ' O ' ' C ' ' B' ' 378' ' ' ILE . 2.3 mm? -58.18 -65.34 0.66 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.9 -1.046 . . . . 0.0 112.749 -178.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . 0.494 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 63.2 m-85 -73.64 -42.37 61.5 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -177.351 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.554 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -78.36 -52.9 7.9 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.503 -0.479 . . . . 0.0 111.671 -179.267 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.489 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.6 OUTLIER -76.32 -31.28 58.08 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -178.376 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.475 ' C ' ' O ' ' B' ' 374' ' ' LEU . 4.3 mm -141.56 39.12 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.81 -179.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.494 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -115.34 94.24 0.65 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.351 -0.928 . . . . 0.0 113.338 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.596 ' CE2' ' HB2' ' B' ' 382' ' ' SER . 0.4 OUTLIER -145.77 -178.11 5.94 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.278 -0.268 . . . . 0.0 110.278 179.448 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -91.76 75.92 5.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.9 0.381 . . . . 0.0 111.373 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 382' ' ' SER . . . . . 0.596 ' HB2' ' CE2' ' B' ' 380' ' ' TYR . 0.7 OUTLIER -170.31 -68.68 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.864 179.686 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.603 ' HB2' ' CE2' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -51.12 -41.4 60.03 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.183 -0.302 . . . . 0.0 110.183 179.612 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . 0.463 ' C ' HD21 ' B' ' 383' ' ' LEU . 2.1 tpt85 72.78 89.41 0.09 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 178.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.54 HD23 ' CD1' ' B' ' 387' ' ' TYR . 0.1 OUTLIER -63.89 147.08 52.77 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.647 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . 0.538 ' CB ' ' O ' ' B' ' 405' ' ' ARG . 0.1 OUTLIER -147.94 70.18 1.14 Allowed 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -178.943 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.54 ' CD1' HD23 ' B' ' 385' ' ' LEU . 4.0 m-85 -91.59 113.65 25.97 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.383 177.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . 0.436 HG23 ' HB3' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -109.28 133.11 55.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.735 0.302 . . . . 0.0 110.706 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 5.3 m -87.76 125.35 34.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.0 0.429 . . . . 0.0 110.536 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.525 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 27.1 m -131.38 159.68 42.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.582 -179.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.525 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 88.4 23.48 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.45 179.41 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.519 ' O ' ' O ' ' B' ' 391' ' ' LYS . 9.6 mmtt 1.78 118.28 0.0 OUTLIER Pre-proline 0 N--CA 1.472 0.673 0 O-C-N 124.249 0.968 . . . . 0.0 112.476 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.483 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 22.8 Cg_exo -61.01 162.59 18.78 Favored 'Trans proline' 0 N--CA 1.463 -0.272 0 C-N-CA 122.677 2.251 . . . . 0.0 113.153 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 2.9 p -127.82 170.46 12.76 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.768 -1.106 . . . . 0.0 111.194 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -97.09 19.64 12.59 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.227 0.537 . . . . 0.0 110.905 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 31.5 m -137.5 8.24 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.946 178.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . 0.495 ' O ' ' N ' ' B' ' 399' ' ' ASN . 1.2 m-20 164.91 62.47 0.0 OUTLIER Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 114.82 -1.082 . . . . 0.0 108.929 -179.289 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.535 ' HB2' ' O ' ' B' ' 418' ' ' ARG . 47.2 Cg_exo -34.04 -25.78 0.03 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 123.882 3.055 . . . . 0.0 113.943 -179.079 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.527 ' C ' ' O ' ' B' ' 398' ' ' PRO . 23.0 m120 -16.19 122.04 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 179.645 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 400' ' ' SER . . . . . 0.418 ' O ' HG23 ' B' ' 416' ' ' VAL . 0.9 OUTLIER -143.61 151.72 40.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.014 0.435 . . . . 0.0 111.303 -179.887 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.563 HG13 ' N ' ' B' ' 402' ' ' VAL . 0.7 OUTLIER -116.8 144.95 23.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.188 -179.591 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.563 ' N ' HG13 ' B' ' 401' ' ' ILE . 0.2 OUTLIER -110.25 150.22 12.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.294 -179.714 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.465 ' O ' ' HA ' ' B' ' 387' ' ' TYR . 0.1 OUTLIER -109.43 103.7 12.65 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-O 120.922 0.392 . . . . 0.0 109.965 178.967 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.47 ' SG ' ' O ' ' B' ' 413' ' ' GLY . 0.0 OUTLIER -81.4 91.2 6.25 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 179.296 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.563 ' CG ' ' O ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -133.97 152.27 51.79 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.202 -179.046 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.548 ' N ' ' HG2' ' B' ' 405' ' ' ARG . 0.9 OUTLIER -126.41 -174.5 1.08 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.507 0 CA-C-O 120.852 0.358 . . . . 0.0 111.202 -179.735 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 57.33 -94.4 0.04 OUTLIER Glycine 0 C--N 1.335 0.495 0 C-N-CA 120.791 -0.719 . . . . 0.0 111.872 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -164.45 26.51 0.07 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.019 0.438 . . . . 0.0 109.843 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 168.35 -16.48 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.526 -0.845 . . . . 0.0 113.146 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.563 ' O ' ' CG ' ' B' ' 405' ' ' ARG . 56.5 m -70.17 133.6 47.26 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 179.137 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . 0.551 ' O ' ' HB2' ' B' ' 412' ' ' LEU . 39.2 t -85.04 -115.15 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 C-N-CA 120.22 -0.592 . . . . 0.0 112.012 -178.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.551 ' HB2' ' O ' ' B' ' 411' ' ' VAL . 0.0 OUTLIER 138.24 -45.85 0.01 OUTLIER 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 -178.357 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . 0.488 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 173.38 -176.45 46.04 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 114.97 -1.014 . . . . 0.0 112.564 179.442 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.516 ' O ' ' ND2' ' B' ' 430' ' ' ASN . 0.2 OUTLIER -144.04 155.26 43.92 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.749 -0.226 . . . . 0.0 110.731 -179.719 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.466 ' CA ' ' HG3' ' B' ' 426' ' ' ARG . . . -146.18 140.96 9.19 Favored Glycine 0 C--O 1.226 -0.365 0 C-N-CA 120.063 -1.065 . . . . 0.0 112.853 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . 0.418 HG23 ' O ' ' B' ' 400' ' ' SER . 9.4 p -130.94 152.35 37.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.55 0.214 . . . . 0.0 110.474 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.544 ' HA3' ' CD1' ' B' ' 422' ' ' ILE . . . -164.45 155.29 26.6 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.589 -0.815 . . . . 0.0 112.48 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.535 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 1.5 ptm180 -64.2 -44.05 93.15 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.514 ' O ' HG13 ' B' ' 420' ' ' ILE . 0.6 OUTLIER -102.4 31.58 3.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.584 0.23 . . . . 0.0 110.412 179.304 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.592 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 54.28 -45.39 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 N-CA-C 114.676 1.361 . . . . 0.0 114.676 178.752 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.635 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -44.41 -57.24 3.66 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.635 ' N ' ' HD3' ' B' ' 421' ' ' LYS . 0.1 OUTLIER -47.87 -24.27 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.328 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.592 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -79.62 -48.46 13.71 Favored 'General case' 0 N--CA 1.439 -1.017 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 177.05 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -59.17 -50.33 68.9 Favored Glycine 0 N--CA 1.449 -0.477 0 N-CA-C 110.165 -1.174 . . . . 0.0 110.165 178.116 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . 0.51 ' CD1' ' HG2' ' B' ' 421' ' ' LYS . 1.2 mp -59.47 -66.82 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 177.457 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.58 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 10.4 tpt180 -38.07 -31.87 0.06 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.091 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.493 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -62.92 -62.39 1.75 Allowed 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.509 178.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.571 ' CB ' ' CB ' ' B' ' 370' ' ' ALA . . . -53.49 -50.26 65.74 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.59 ' O ' ' CD2' ' B' ' 432' ' ' LEU . 0.6 OUTLIER -56.03 -18.87 10.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.76 179.235 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.516 ' ND2' ' O ' ' B' ' 414' ' ' THR . 0.8 OUTLIER -81.34 -38.72 26.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.57 -0.287 . . . . 0.0 110.808 179.644 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.465 ' HB3' ' OH ' ' B' ' 387' ' ' TYR . . . -72.91 -33.42 65.98 Favored 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -178.246 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.592 ' C ' ' CD2' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -81.76 8.84 9.07 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.887 0.375 . . . . 0.0 111.527 -179.443 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . 0.538 ' CG ' ' O ' ' B' ' 429' ' ' GLU . 1.3 mtm180 -85.6 -3.91 59.01 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.939 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -115.25 79.55 1.3 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.386 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.542 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -48.0 -54.27 13.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.719 0.295 . . . . 0.0 111.071 -179.799 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.542 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 13.7 mtpp -55.2 -40.9 71.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.84 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.471 ' O ' ' HB3' ' B' ' 440' ' ' PHE . 17.5 tmm? -69.48 -52.97 21.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.993 0.425 . . . . 0.0 110.139 179.282 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.471 HD22 ' OE1' ' B' ' 373' ' ' GLN . 74.3 mt -50.73 -61.9 1.92 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.544 0.688 . . . . 0.0 110.329 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -49.43 -48.16 47.57 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.922 -1.035 . . . . 0.0 109.543 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.515 ' C ' ' CD1' ' B' ' 440' ' ' PHE . 0.1 OUTLIER -43.75 -42.67 5.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.484 179.743 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.603 ' CE2' ' HB2' ' B' ' 383' ' ' LEU . 36.8 m-85 -69.88 -36.74 75.69 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.094 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -51.34 -60.73 2.8 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 178.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . 0.424 ' C ' ' CD ' ' B' ' 443' ' ' LYS . 0.0 OUTLIER -48.08 -43.21 30.42 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.064 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . 0.518 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -55.38 -55.83 27.07 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.262 178.954 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.577 ' HD2' ' CD2' ' B' ' 380' ' ' TYR . 0.2 OUTLIER -44.39 -36.98 3.1 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.347 179.582 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -81.43 -36.37 29.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.642 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.238 -179.663 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 366' ' ' LEU . . . . . 0.504 ' O ' ' HB2' ' B' ' 369' ' ' ASN . 3.7 tp . . . . . 0 CA--C 1.522 -0.125 0 CA-C-O 120.74 0.305 . . . . 0.0 111.54 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.546 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.1 OUTLIER -36.7 -77.11 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.917 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.548 ' CE ' ' N ' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -36.05 -41.28 0.24 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.988 178.994 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . 0.548 ' N ' ' CE ' ' B' ' 368' ' ' MET . 1.7 m-80 -61.8 -44.44 96.85 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.409 179.181 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.575 ' O ' ' N ' ' B' ' 373' ' ' GLN . . . -56.89 -68.46 0.22 Allowed 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.632 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.487 ' CE ' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -34.56 -47.93 0.34 Allowed 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.029 0.442 . . . . 0.0 110.35 -179.919 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.591 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.0 OUTLIER -56.57 -39.78 74.07 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.008 179.654 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.575 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.8 OUTLIER -63.62 -60.29 3.51 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.581 0.705 . . . . 0.0 110.751 179.31 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.518 HD13 ' CB ' ' B' ' 428' ' ' ALA . 0.2 OUTLIER -49.19 -72.47 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.114 -0.948 . . . . 0.0 113.428 -178.424 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -89.01 -2.99 58.84 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -176.496 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.591 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -119.04 5.73 11.32 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 119.915 -0.714 . . . . 0.0 111.415 179.811 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.523 ' HB3' ' O ' ' B' ' 373' ' ' GLN . 9.9 tp -144.11 -32.91 0.42 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.493 179.215 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.527 ' CG1' ' OE1' ' B' ' 373' ' ' GLN . 3.8 mm -134.58 37.15 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 120.836 0.35 . . . . 0.0 111.378 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . . . . . . . . . . . -120.75 93.02 0.52 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.623 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.591 ' CZ ' ' HG ' ' B' ' 383' ' ' LEU . 0.1 OUTLIER -126.93 -98.58 0.39 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.519 0.199 . . . . 0.0 110.985 179.633 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -155.58 -41.42 0.08 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.737 0.303 . . . . 0.0 111.426 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.26 -51.1 69.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.912 0.387 . . . . 0.0 110.645 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.591 ' HG ' ' CZ ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -92.13 37.43 0.98 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.873 179.843 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . 0.495 ' CG ' ' O ' ' B' ' 384' ' ' ARG . 2.0 ptm180 -26.21 97.7 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.921 -179.632 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.55 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 0.3 OUTLIER -59.89 163.04 4.88 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.955 179.374 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . 0.488 ' CB ' ' O ' ' B' ' 405' ' ' ARG . 0.0 OUTLIER -160.27 83.71 0.71 Allowed 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -179.188 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.561 ' CE2' ' SG ' ' B' ' 404' ' ' CYS . 60.4 m-85 -87.77 114.91 24.83 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 177.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -123.9 115.48 45.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.494 -0.483 . . . . 0.0 112.302 -179.372 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 3.9 m -70.37 128.86 37.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.543 179.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.54 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 19.9 m -132.71 159.89 42.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.6 -179.385 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.54 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 92.68 36.85 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.771 179.743 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.51 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER 0.94 117.82 0.0 OUTLIER Pre-proline 0 N--CA 1.472 0.634 0 O-C-N 124.038 0.836 . . . . 0.0 112.704 179.596 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.527 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 26.4 Cg_exo -60.37 163.76 14.3 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.669 2.246 . . . . 0.0 113.249 -179.688 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 394' ' ' THR . . . . . 0.461 ' O ' ' HD3' ' B' ' 398' ' ' PRO . 18.2 p -135.43 172.42 13.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.055 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -98.05 18.36 16.24 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 121.174 0.512 . . . . 0.0 110.472 179.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . 0.404 HG23 ' OG1' ' B' ' 394' ' ' THR . 11.4 m -125.47 -0.85 5.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.967 178.414 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . 0.528 ' O ' ' N ' ' B' ' 399' ' ' ASN . 11.6 m-20 170.61 54.47 0.01 OUTLIER Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 114.625 -1.17 . . . . 0.0 108.599 -179.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.527 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 76.8 Cg_exo -29.56 -32.36 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 124.089 3.193 . . . . 0.0 113.517 -178.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.541 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 6.5 p30 -25.45 142.06 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.863 -178.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -140.79 158.07 44.49 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.643 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.582 ' CD1' ' CG2' ' B' ' 416' ' ' VAL . 0.2 OUTLIER -110.48 144.49 18.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.432 -0.803 . . . . 0.0 111.303 -179.399 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.564 ' N ' HG13 ' B' ' 401' ' ' ILE . 0.3 OUTLIER -109.7 146.21 15.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.777 -179.202 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -111.79 95.95 5.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.073 179.093 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.561 ' SG ' ' CE2' ' B' ' 387' ' ' TYR . 4.6 t -75.89 87.1 2.86 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.347 -0.842 . . . . 0.0 108.873 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.55 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -133.17 152.83 51.93 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.109 -179.205 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.55 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.9 OUTLIER -145.94 151.27 14.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.714 -179.103 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 67.79 -103.91 1.06 Allowed Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.736 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -149.68 2.76 0.54 Allowed 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -166.37 22.61 0.12 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 119.896 -1.145 . . . . 0.0 113.18 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.55 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 0.2 OUTLIER -116.31 97.61 6.13 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 117.116 0.458 . . . . 0.0 110.926 179.536 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . 0.544 ' O ' ' N ' ' B' ' 413' ' ' GLY . 56.1 t -106.36 64.92 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.705 179.18 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.469 ' C ' ' O ' ' B' ' 411' ' ' VAL . 0.1 OUTLIER -30.66 -35.33 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 120.676 0.274 . . . . 0.0 110.907 -179.56 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . 0.544 ' N ' ' O ' ' B' ' 411' ' ' VAL . . . 165.97 -157.38 29.82 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 119.721 -1.228 . . . . 0.0 113.494 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.5 ' O ' ' ND2' ' B' ' 430' ' ' ASN . 1.1 t -153.89 174.05 15.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.27 -0.465 . . . . 0.0 111.803 -178.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.481 ' HA2' ' HD2' ' B' ' 426' ' ' ARG . . . -158.02 139.76 6.56 Favored Glycine 0 C--O 1.222 -0.641 0 C-N-CA 120.298 -0.953 . . . . 0.0 113.123 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . 0.582 ' CG2' ' CD1' ' B' ' 401' ' ' ILE . 41.5 t -126.13 149.92 31.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 179.118 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.541 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -163.0 162.16 34.46 Favored Glycine 0 C--O 1.225 -0.407 0 C-N-CA 120.126 -1.035 . . . . 0.0 112.465 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.539 ' N ' HD12 ' B' ' 422' ' ' ILE . 1.6 ptt180 -76.95 -41.87 41.45 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.707 0.254 . . . . 0.0 111.684 -179.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.481 ' O ' HG13 ' B' ' 420' ' ' ILE . 0.2 OUTLIER -101.65 27.59 6.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.034 0.445 . . . . 0.0 109.824 179.009 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.587 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 55.75 -44.76 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 178.485 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.657 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.2 OUTLIER -43.49 -58.92 2.37 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 179.565 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.657 ' N ' ' HD3' ' B' ' 421' ' ' LYS . 0.1 OUTLIER -45.82 -26.23 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.667 178.658 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.587 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -77.51 -47.66 19.0 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 177.224 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -63.6 -55.67 23.84 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.732 178.779 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . 0.514 ' CG1' ' HB3' ' B' ' 367' ' ' ASP . 0.9 OUTLIER -58.25 -71.71 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 178.621 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.546 ' HB3' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -44.16 -26.19 0.29 Allowed 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.699 -178.743 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.567 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -61.62 -54.48 42.37 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 176.809 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.518 ' CB ' HD13 ' B' ' 374' ' ' LEU . . . -53.47 -49.49 67.34 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 107.964 -1.125 . . . . 0.0 107.964 177.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.558 ' O ' ' CD2' ' B' ' 432' ' ' LEU . 49.7 mt-10 -53.99 -21.97 9.38 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.365 178.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.567 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.7 OUTLIER -75.73 -37.28 59.54 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 178.341 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.44 ' O ' ' HE1' ' B' ' 437' ' ' MET . . . -68.49 -48.47 64.36 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.299 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.558 ' CD2' ' O ' ' B' ' 429' ' ' GLU . 0.1 OUTLIER -76.91 1.31 17.99 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.117 0.484 . . . . 0.0 111.343 -179.953 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.82 -14.26 61.92 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.883 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . 0.482 ' HB2' ' HB3' ' B' ' 437' ' ' MET . 5.6 m-20 -120.76 86.64 2.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.927 -178.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.583 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 6.1 ptpp? -52.61 -52.62 54.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.983 0.421 . . . . 0.0 110.213 179.275 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.583 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 5.4 mtpp -50.63 -36.41 35.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.546 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.482 ' HB3' ' HB2' ' B' ' 434' ' ' ASP . 1.1 ttp -80.11 -44.76 19.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.724 179.008 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.541 ' CD1' ' HA ' ' B' ' 432' ' ' LEU . 87.2 mt -53.08 -63.01 1.28 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.669 0.747 . . . . 0.0 109.545 178.709 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . 0.405 ' O ' ' C ' ' B' ' 440' ' ' PHE . 9.1 t70 -55.57 -44.51 76.93 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.029 -0.987 . . . . 0.0 108.973 178.507 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.469 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.1 OUTLIER -41.6 -42.26 2.41 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.187 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.54 ' CE1' ' HB2' ' B' ' 383' ' ' LEU . 46.3 m-85 -68.11 -46.45 70.87 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.232 -0.894 . . . . 0.0 110.675 179.348 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -42.82 -60.82 1.45 Allowed 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 178.701 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.67 -44.21 57.63 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.84 178.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . 0.441 ' HB2' ' O ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -55.11 -55.38 31.7 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.06 179.278 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.566 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.1 OUTLIER -50.49 -41.56 53.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.559 -179.89 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -65.72 -46.09 80.25 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.092 0.472 . . . . 0.0 110.263 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.76 -179.315 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 366' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.457 -0.075 0 CA-C-O 120.876 0.37 . . . . 0.0 111.208 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.497 ' OD1' ' N ' ' B' ' 367' ' ' ASP . 0.1 OUTLIER -58.16 -64.96 0.73 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.941 179.363 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.441 ' HA ' ' HD2' ' B' ' 371' ' ' LYS . 1.4 ttp -33.74 -48.21 0.27 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.912 179.75 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 32.2 m-20 -61.8 -45.48 93.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.811 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.582 ' O ' ' N ' ' B' ' 373' ' ' GLN . . . -59.69 -69.67 0.2 Allowed 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.448 ' HE2' ' CB ' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -32.92 -52.74 0.34 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.977 0.418 . . . . 0.0 110.699 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.412 ' HD3' ' HA ' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -58.4 -37.44 75.31 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.074 -179.966 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.582 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -64.09 -65.91 0.61 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.598 0.713 . . . . 0.0 110.904 179.558 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.508 HD23 ' O ' ' B' ' 428' ' ' ALA . 4.3 mm? -48.14 -68.23 0.2 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.208 -0.906 . . . . 0.0 112.621 -179.217 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -79.4 -42.66 25.01 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 -176.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.472 ' O ' HD23 ' B' ' 377' ' ' LEU . 0.0 OUTLIER -91.54 10.46 27.83 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -177.619 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.561 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.3 OUTLIER -140.67 -38.18 0.44 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.66 0.266 . . . . 0.0 111.213 179.264 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.44 HD11 ' O ' ' B' ' 377' ' ' LEU . 5.7 mm -121.73 34.64 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 121.081 0.467 . . . . 0.0 110.966 179.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . . . . . . . . . . . -149.31 69.75 0.33 Allowed Glycine 0 N--CA 1.453 -0.232 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.908 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.594 ' CG ' ' HD3' ' B' ' 445' ' ' ARG . 2.2 p90 -61.98 -59.87 4.46 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 -179.035 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . 170.29 -29.64 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.875 0.369 . . . . 0.0 111.59 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.39 40.9 1.86 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.321 179.6 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . . . . . . . . . 6.7 tt -115.35 -40.51 3.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.827 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 65.3 65.97 0.55 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.198 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.468 HD13 ' CG1' ' B' ' 406' ' ' VAL . 0.7 OUTLIER -48.65 155.84 0.52 Allowed 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.482 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . 0.505 ' O ' ' O ' ' B' ' 405' ' ' ARG . 0.9 OUTLIER -153.3 98.17 2.24 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -178.681 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.702 ' HB2' ' HA ' ' B' ' 404' ' ' CYS . 0.1 OUTLIER -139.72 151.54 45.94 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.929 176.553 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -144.51 163.65 13.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.749 -177.079 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 3.4 m -102.78 129.95 49.59 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.077 0.465 . . . . 0.0 110.898 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.56 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 5.4 m -134.92 162.42 38.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.01 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.56 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 98.92 28.55 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.206 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.526 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.1 OUTLIER 0.37 117.52 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.679 0 O-C-N 124.119 0.887 . . . . 0.0 112.247 179.851 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.504 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 18.7 Cg_exo -62.72 158.35 42.68 Favored 'Trans proline' 0 N--CA 1.463 -0.304 0 C-N-CA 122.477 2.118 . . . . 0.0 113.401 -179.229 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 394' ' ' THR . . . . . 0.496 ' O ' ' HD3' ' B' ' 398' ' ' PRO . 15.9 p -137.96 167.53 21.57 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.5 -1.227 . . . . 0.0 111.096 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -92.29 17.19 10.12 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-O 121.262 0.553 . . . . 0.0 110.22 179.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . 0.407 ' O ' ' CG ' ' B' ' 397' ' ' ASP . 17.4 m -125.67 -6.52 5.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.166 -0.924 . . . . 0.0 109.944 177.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . 0.465 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 28.9 m-20 179.45 54.46 0.05 OUTLIER Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 114.623 -1.172 . . . . 0.0 108.749 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.504 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 57.6 Cg_exo -31.76 -38.38 0.07 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 123.746 2.964 . . . . 0.0 113.643 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.593 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -28.31 139.91 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.493 0.663 . . . . 0.0 112.652 -177.775 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 12.0 t -141.09 148.79 40.7 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.964 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.462 ' HA ' ' HA ' ' B' ' 416' ' ' VAL . 12.1 tt -107.57 156.22 8.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 121.133 0.492 . . . . 0.0 111.875 -179.508 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.476 HG21 ' O ' ' B' ' 415' ' ' GLY . 0.2 OUTLIER -127.99 141.1 47.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.652 -179.381 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.55 ' O ' ' HB2' ' B' ' 387' ' ' TYR . 0.7 OUTLIER -100.76 94.1 5.9 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.027 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.702 ' HA ' ' HB2' ' B' ' 387' ' ' TYR . 1.1 p -82.26 99.08 9.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.861 0.839 . . . . 0.0 110.391 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.532 ' CB ' ' O ' ' B' ' 410' ' ' THR . 0.2 OUTLIER -132.48 164.63 26.15 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.704 -178.71 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.514 ' N ' ' HG3' ' B' ' 405' ' ' ARG . 1.2 m -132.59 128.5 57.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.953 0.406 . . . . 0.0 111.96 -178.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . 0.472 ' O ' ' HB3' ' B' ' 408' ' ' ASP . . . 79.64 8.49 87.68 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.921 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . 0.472 ' HB3' ' O ' ' B' ' 407' ' ' GLY . 9.2 t70 66.88 11.68 8.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.87 0.367 . . . . 0.0 110.632 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -125.97 -37.29 0.51 Allowed Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.492 -0.861 . . . . 0.0 112.99 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.532 ' O ' ' CB ' ' B' ' 405' ' ' ARG . 95.0 m -103.13 136.77 42.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.959 0.409 . . . . 0.0 112.035 -179.097 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . 0.494 ' HA ' ' HB2' ' B' ' 405' ' ' ARG . 79.1 t -120.15 80.25 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.726 179.382 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.553 ' CB ' ' HA ' ' B' ' 431' ' ' ALA . 0.1 OUTLIER -41.19 -38.66 1.14 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.889 179.75 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . 0.468 ' O ' ' SG ' ' B' ' 404' ' ' CYS . . . 172.34 -169.73 42.82 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.374 -0.917 . . . . 0.0 112.916 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.458 ' OG1' ' O ' ' B' ' 402' ' ' VAL . 2.2 t -145.21 138.09 26.25 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.754 0.312 . . . . 0.0 111.207 -178.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.553 ' CA ' ' HG3' ' B' ' 426' ' ' ARG . . . -117.87 133.43 10.45 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.239 -0.982 . . . . 0.0 113.761 -179.013 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . 0.462 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 11.7 p -117.38 153.96 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 178.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.593 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -161.98 157.64 29.46 Favored Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.18 -1.01 . . . . 0.0 111.67 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.527 ' HA ' ' CB ' ' B' ' 399' ' ' ASN . 1.9 ptm180 -73.67 -40.29 63.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.918 0.39 . . . . 0.0 111.608 -179.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.559 ' O ' HG13 ' B' ' 420' ' ' ILE . 8.2 t30 -100.91 27.17 6.2 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.65 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.59 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 54.91 -47.76 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 179.82 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.503 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -43.62 -59.02 2.37 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.116 -0.633 . . . . 0.0 109.377 -179.714 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.616 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.0 OUTLIER -44.39 -22.2 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.325 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.844 177.906 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.59 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -80.95 -49.79 10.54 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 177.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . 0.446 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -56.36 -48.65 74.02 Favored Glycine 0 C--N 1.337 0.631 0 C-N-CA 119.586 -1.292 . . . . 0.0 110.3 178.344 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . 0.551 ' O ' ' N ' ' B' ' 428' ' ' ALA . 1.2 mp -65.4 -64.75 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 177.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.616 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 14.8 tpt180 -39.08 -31.27 0.07 Allowed 'General case' 0 C--O 1.225 -0.196 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.586 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -65.25 -52.32 55.23 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 178.053 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.551 ' N ' ' O ' ' B' ' 425' ' ' ILE . . . -55.91 -51.83 66.23 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 177.516 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.517 ' O ' HD23 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -57.93 -31.65 67.02 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.862 179.251 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.586 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 19.0 m120 -57.43 -41.21 80.01 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.553 ' HA ' ' CB ' ' B' ' 412' ' ' LEU . . . -69.03 -45.14 71.23 Favored 'General case' 0 CA--C 1.527 0.084 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.686 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.53 ' HA ' ' CD1' ' B' ' 438' ' ' LEU . 0.0 OUTLIER -77.67 -9.84 59.19 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.841 0.353 . . . . 0.0 111.445 -179.382 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . 0.492 ' HG2' ' HA ' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -80.08 16.82 1.12 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.672 -179.504 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . 0.462 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 90.3 m-20 -140.27 79.85 1.73 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.656 0.265 . . . . 0.0 110.337 179.103 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.589 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -46.69 -58.5 3.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.801 -179.551 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.589 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 1.6 mmpp? -49.65 -37.14 27.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.89 0.376 . . . . 0.0 110.451 -179.45 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.481 ' O ' ' HB3' ' B' ' 440' ' ' PHE . 0.5 OUTLIER -73.84 -51.46 16.21 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.498 179.284 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.53 ' CD1' ' HA ' ' B' ' 432' ' ' LEU . 90.0 mt -52.36 -61.7 2.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.283 0.563 . . . . 0.0 110.691 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . 0.475 ' O ' ' N ' ' B' ' 442' ' ' ALA . 3.5 t70 -48.69 -51.13 30.15 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 178.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.481 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -40.13 -42.65 1.49 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.063 179.83 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.52 ' O ' ' N ' ' B' ' 444' ' ' GLN . 49.8 m-85 -67.72 -42.02 82.59 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.781 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . 0.516 ' O ' ' N ' ' B' ' 445' ' ' ARG . . . -43.04 -59.31 2.07 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 177.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.2 -42.91 41.69 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 177.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . 0.523 ' NE2' ' O ' ' B' ' 444' ' ' GLN . 0.0 OUTLIER -73.39 3.59 5.78 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.906 179.017 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.594 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -99.23 -45.02 6.03 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.371 179.238 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -79.38 -34.8 41.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.728 179.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.792 -179.835 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 366' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.455 -0.189 0 CA-C-O 120.877 0.37 . . . . 0.0 111.081 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.461 ' OD2' HG13 ' B' ' 425' ' ' ILE . 3.9 t70 -59.58 -61.56 2.53 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.809 179.329 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.505 ' HA ' ' CD ' ' B' ' 371' ' ' LYS . 8.8 ttp -34.6 -50.47 0.45 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.611 179.477 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -61.92 -48.01 82.35 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.694 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.589 ' CB ' ' CB ' ' B' ' 428' ' ' ALA . . . -64.94 -72.5 0.15 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.743 0.306 . . . . 0.0 110.69 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.505 ' CD ' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -34.86 -42.55 0.16 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.857 179.828 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.556 ' O ' ' CB ' ' B' ' 376' ' ' SER . 1.8 ttp-105 -66.64 -39.23 88.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.235 -179.792 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.561 ' HG3' ' CG ' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -62.49 -54.67 36.63 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.209 0.528 . . . . 0.0 110.415 179.54 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.463 ' N ' HD23 ' B' ' 374' ' ' LEU . 1.1 mm? -55.93 -68.53 0.2 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.267 -0.878 . . . . 0.0 113.048 -179.102 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . 0.469 ' O ' ' O ' ' B' ' 378' ' ' ILE . 3.5 m-85 -74.91 -45.13 44.72 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -177.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.556 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -70.8 -54.25 12.33 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.319 -0.552 . . . . 0.0 111.386 -179.404 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.517 ' CB ' ' O ' ' B' ' 373' ' ' GLN . 0.0 OUTLIER -71.02 -43.59 67.61 Favored 'General case' 0 CA--C 1.509 -0.618 0 CA-C-O 121.196 0.522 . . . . 0.0 109.971 -178.856 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.469 ' O ' ' O ' ' B' ' 375' ' ' TYR . 2.4 mm -120.36 -138.5 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.926 0 CA-C-N 115.374 -0.83 . . . . 0.0 108.878 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.522 ' O ' ' O ' ' B' ' 380' ' ' TYR . . . 99.53 -22.37 40.91 Favored Glycine 0 C--N 1.321 -0.3 0 C-N-CA 120.943 -0.646 . . . . 0.0 112.089 -179.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.597 ' HB3' HD22 ' B' ' 383' ' ' LEU . 0.1 OUTLIER 34.92 -175.41 0.0 OUTLIER 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 178.867 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -121.16 -28.2 4.76 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 113.092 -1.867 . . . . 0.0 109.985 179.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -143.57 50.49 1.37 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.653 179.622 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.597 HD22 ' HB3' ' B' ' 380' ' ' TYR . 0.8 OUTLIER -116.4 -36.14 4.09 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 120.913 0.387 . . . . 0.0 110.421 178.857 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . 0.515 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 1.9 tpt85 74.71 78.76 0.11 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.718 179.173 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.51 ' HA ' ' HB ' ' B' ' 406' ' ' VAL . 9.7 tt -107.25 124.29 49.54 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 178.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . 0.421 ' O ' ' O ' ' B' ' 405' ' ' ARG . 26.4 p-80 -145.22 145.91 31.5 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 -178.185 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.577 ' CZ ' ' HB3' ' B' ' 404' ' ' CYS . 3.9 m-85 -106.05 147.74 28.55 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 114.56 -1.2 . . . . 0.0 111.066 178.319 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . 0.519 HG21 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -133.43 128.64 55.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.351 179.448 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.2 m -86.83 123.75 32.31 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.963 179.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.534 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 29.1 m -130.06 154.84 40.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.363 0.602 . . . . 0.0 112.222 -179.314 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.54 ' O ' ' C ' ' B' ' 392' ' ' LYS . 4.4 tptt 90.7 23.68 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.544 179.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.54 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.1 OUTLIER 1.71 108.37 0.01 OUTLIER Pre-proline 0 N--CA 1.468 0.439 0 O-C-N 123.966 0.792 . . . . 0.0 112.44 179.766 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.486 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 6.0 Cg_exo -45.55 160.41 0.16 Allowed 'Trans proline' 0 N--CA 1.462 -0.33 0 C-N-CA 122.856 2.37 . . . . 0.0 113.514 -179.174 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 31.8 p -127.2 169.76 13.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.53 179.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -96.19 20.21 10.65 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 121.24 0.543 . . . . 0.0 110.715 179.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 33.6 m -136.05 6.64 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.005 178.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . 0.455 ' O ' ' N ' ' B' ' 399' ' ' ASN . 0.2 OUTLIER 168.17 58.09 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 114.949 -1.023 . . . . 0.0 108.847 -179.38 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.486 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 3.3 Cg_exo -35.64 -27.3 0.05 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 124.062 3.175 . . . . 0.0 113.108 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.579 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 1.3 p-10 -29.28 120.43 0.14 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.619 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 400' ' ' SER . . . . . 0.448 ' OG ' ' HD3' ' B' ' 393' ' ' PRO . 48.9 m -130.71 158.17 40.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.906 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.535 HG13 ' N ' ' B' ' 402' ' ' VAL . 0.4 OUTLIER -115.14 144.89 21.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.991 -179.796 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.535 ' N ' HG13 ' B' ' 401' ' ' ILE . 0.2 OUTLIER -110.77 157.59 11.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.558 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.519 ' CB ' HG21 ' B' ' 388' ' ' VAL . 2.4 mm-40 -123.9 119.4 29.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.102 179.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.577 ' HB3' ' CZ ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -102.39 103.23 13.63 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.669 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.524 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.8 OUTLIER -142.68 170.44 15.7 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.125 -179.305 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.515 ' HB ' ' O ' ' B' ' 384' ' ' ARG . 1.0 OUTLIER -148.57 177.69 0.88 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.547 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.515 -179.03 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 58.2 -102.84 0.28 Allowed Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 115.153 -0.93 . . . . 0.0 112.577 179.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -158.13 21.16 0.25 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.751 0.31 . . . . 0.0 110.842 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 170.99 31.95 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.667 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.524 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 99.3 m -124.31 111.68 16.1 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 121.05 -0.26 . . . . 0.0 110.983 179.519 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . 0.466 HG11 ' OE1' ' B' ' 403' ' ' GLU . 58.2 t -103.61 107.43 22.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 178.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.548 ' HB3' ' HA ' ' B' ' 431' ' ' ALA . 0.0 OUTLIER -68.42 -26.11 65.37 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.633 -179.829 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . 0.464 ' O ' ' SG ' ' B' ' 404' ' ' CYS . . . 174.34 -177.22 46.61 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.874 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.443 ' O ' ' ND2' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -146.37 152.68 39.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.787 -0.206 . . . . 0.0 110.79 -179.832 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.442 ' O ' HG13 ' B' ' 401' ' ' ILE . . . -149.53 158.06 27.5 Favored Glycine 0 C--O 1.227 -0.302 0 C-N-CA 119.757 -1.211 . . . . 0.0 113.647 -179.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . 0.455 ' HB ' HD11 ' B' ' 401' ' ' ILE . 1.4 p -141.4 151.41 19.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.528 -0.336 . . . . 0.0 110.779 179.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.579 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -165.18 142.91 8.05 Favored Glycine 0 C--O 1.228 -0.265 0 C-N-CA 120.957 -0.639 . . . . 0.0 111.732 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.52 ' CG ' ' OD1' ' B' ' 419' ' ' ASN . 4.7 ptm180 -60.64 -43.77 97.18 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -179.059 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.545 ' O ' HG13 ' B' ' 420' ' ' ILE . 0.1 OUTLIER -100.19 34.35 2.37 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 178.893 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.61 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 51.09 -46.39 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 N-CA-C 114.746 1.387 . . . . 0.0 114.746 179.328 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.544 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -43.96 -58.61 2.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 118.784 0.72 . . . . 0.0 109.768 -179.71 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.601 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.0 OUTLIER -45.06 -19.84 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 177.261 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.61 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -88.0 -49.26 7.17 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 177.607 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . 0.464 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -58.8 -44.79 95.68 Favored Glycine 0 C--N 1.339 0.708 0 C-N-CA 119.914 -1.136 . . . . 0.0 110.775 178.538 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . 0.461 HG13 ' OD2' ' B' ' 367' ' ' ASP . 2.4 mp -67.25 -64.86 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 178.055 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.601 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -40.41 -26.56 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.816 179.039 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.429 ' N ' ' O ' ' B' ' 425' ' ' ILE . . . -73.91 -55.28 6.36 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.529 179.428 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.589 ' CB ' ' CB ' ' B' ' 370' ' ' ALA . . . -50.7 -50.57 54.82 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.028 0.442 . . . . 0.0 110.203 179.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.632 ' O ' HD23 ' B' ' 432' ' ' LEU . 0.6 OUTLIER -58.7 -66.15 0.54 Allowed 'General case' 0 C--O 1.218 -0.553 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 178.094 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.502 ' C ' ' O ' ' B' ' 429' ' ' GLU . 0.3 OUTLIER -24.83 -42.29 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.267 179.512 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.548 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -78.23 -39.12 41.31 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.286 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.632 HD23 ' O ' ' B' ' 429' ' ' GLU . 0.0 OUTLIER -78.75 8.42 5.44 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.146 0.498 . . . . 0.0 111.576 179.812 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.64 -5.25 58.8 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.516 -179.426 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . 0.448 ' OD2' ' HB2' ' B' ' 437' ' ' MET . 54.1 t0 -107.02 90.77 3.4 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.843 0.354 . . . . 0.0 111.283 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.551 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.2 OUTLIER -51.62 -53.3 39.93 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.019 179.94 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.551 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.2 OUTLIER -54.52 -43.66 72.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.973 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.528 ' CE ' ' HG ' ' B' ' 412' ' ' LEU . 16.6 tmm? -69.86 -55.4 9.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.852 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.527 ' CD2' ' HA ' ' B' ' 432' ' ' LEU . 69.7 mt -52.81 -62.79 1.42 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.276 0.56 . . . . 0.0 110.337 179.471 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . 0.431 ' O ' ' N ' ' B' ' 442' ' ' ALA . 14.1 t0 -50.53 -47.27 57.61 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.244 -0.889 . . . . 0.0 108.924 178.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.479 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.5 OUTLIER -44.12 -41.16 5.44 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.264 179.565 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.548 ' CE1' HD11 ' B' ' 383' ' ' LEU . 43.2 m-85 -74.2 -31.83 62.81 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.436 179.502 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . 0.431 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -59.32 -61.94 2.25 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.01 -42.58 63.14 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 178.4 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . 0.459 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -54.48 -56.19 21.27 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.547 -0.752 . . . . 0.0 109.691 178.685 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.482 ' HD3' ' CD1' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -46.43 -38.21 8.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.96 179.649 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -77.29 -40.19 45.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.765 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.842 -179.69 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 366' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.456 -0.129 0 CA-C-O 120.735 0.302 . . . . 0.0 111.1 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.535 ' O ' ' N ' ' B' ' 370' ' ' ALA . 4.8 t0 -57.58 -65.61 0.6 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.906 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.533 ' HA ' ' CE ' ' B' ' 371' ' ' LYS . 4.5 tmm? -36.86 -46.84 0.65 Allowed 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.338 0.589 . . . . 0.0 110.256 179.512 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -61.94 -40.71 96.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.684 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.609 ' CB ' ' CB ' ' B' ' 428' ' ' ALA . . . -63.79 -70.36 0.22 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.854 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.544 ' HG2' ' N ' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -35.67 -45.72 0.39 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.842 0.353 . . . . 0.0 110.294 -179.809 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.55 ' O ' ' CB ' ' B' ' 376' ' ' SER . 5.4 tmm_? -62.32 -39.78 94.17 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.861 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.562 ' N ' ' O ' ' B' ' 370' ' ' ALA . 4.3 tm0? -62.05 -58.4 7.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.281 0.562 . . . . 0.0 110.75 179.187 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.506 ' N ' ' CD2' ' B' ' 374' ' ' LEU . 0.9 OUTLIER -50.85 -70.39 0.09 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.992 -1.003 . . . . 0.0 113.136 -178.607 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . 0.526 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.0 m-85 -72.65 -49.92 28.58 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -177.305 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.55 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -65.61 -54.83 22.31 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -178.445 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . . . . . . . . . 3.3 tp -75.53 -26.43 58.05 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -177.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.468 ' HB ' ' O ' ' B' ' 374' ' ' LEU . 10.9 mm -125.18 -58.03 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.526 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -36.61 105.58 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.734 -0.746 . . . . 0.0 113.095 -179.302 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.569 ' CD2' HD11 ' B' ' 383' ' ' LEU . 18.1 p90 -119.58 171.48 8.34 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.758 0.313 . . . . 0.0 110.632 179.33 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . 0.526 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -62.9 104.42 0.55 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.087 -179.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 382' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 2.2 t 86.11 45.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.388 179.701 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.569 HD11 ' CD2' ' B' ' 380' ' ' TYR . 6.3 tt -97.72 -33.62 11.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.596 179.584 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . 0.506 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 0.0 OUTLIER 65.53 62.14 0.67 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.914 179.857 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.557 ' HG ' ' CG1' ' B' ' 406' ' ' VAL . 1.6 tt -108.45 127.97 54.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.661 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . 0.511 ' N ' HD21 ' B' ' 385' ' ' LEU . 35.7 p-80 -154.8 156.79 36.89 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -179.275 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.598 ' CE2' ' HB3' ' B' ' 404' ' ' CYS . 3.6 m-85 -112.45 152.43 28.72 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 114.374 -1.285 . . . . 0.0 110.892 178.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . 0.504 HG23 ' HB3' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -135.51 135.14 51.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.712 179.613 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.4 m -95.22 127.13 41.03 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.457 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.537 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 31.6 m -131.8 157.85 43.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.198 -179.685 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.537 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 87.38 21.73 0.06 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.52 179.737 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.535 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER 0.98 116.83 0.0 OUTLIER Pre-proline 0 N--CA 1.472 0.663 0 O-C-N 124.001 0.813 . . . . 0.0 112.476 179.884 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.492 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 20.5 Cg_exo -61.78 162.73 20.84 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 122.472 2.115 . . . . 0.0 112.641 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 394' ' ' THR . . . . . 0.428 ' CG2' ' C ' ' B' ' 393' ' ' PRO . 0.7 OUTLIER -155.49 166.11 34.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.159 -179.815 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -82.52 8.92 10.39 Favored 'General case' 0 CA--C 1.527 0.089 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.45 178.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 19.1 m -129.61 11.0 2.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.655 0.74 . . . . 0.0 109.208 178.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 168.68 60.07 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 114.605 -1.18 . . . . 0.0 109.297 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.492 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 90.3 Cg_exo -43.99 -54.58 3.71 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.047 2.498 . . . . 0.0 112.759 -179.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.545 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.7 OUTLIER -25.27 132.06 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.989 -178.483 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 400' ' ' SER . . . . . 0.469 ' HB2' ' HG3' ' B' ' 393' ' ' PRO . 4.5 t -137.94 152.84 49.36 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.795 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.536 HG13 ' N ' ' B' ' 402' ' ' VAL . 0.3 OUTLIER -114.92 141.21 32.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.067 0.46 . . . . 0.0 111.201 -179.631 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.536 ' N ' HG13 ' B' ' 401' ' ' ILE . 0.2 OUTLIER -106.27 158.24 6.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.431 179.672 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.504 ' HB3' HG23 ' B' ' 388' ' ' VAL . 63.4 tt0 -125.47 114.41 18.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.884 179.249 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.598 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -99.8 103.31 14.93 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.278 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.568 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.1 OUTLIER -144.41 169.36 18.07 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.327 -179.25 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.557 ' CG1' ' HG ' ' B' ' 385' ' ' LEU . 0.9 OUTLIER -149.76 -177.25 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.336 -178.942 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 56.57 -104.52 0.38 Allowed Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.658 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -155.25 18.44 0.42 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.874 0.369 . . . . 0.0 110.936 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 169.32 33.55 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 121.001 -0.619 . . . . 0.0 112.284 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.568 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 1.2 m -120.07 111.72 18.24 Favored 'General case' 0 C--O 1.22 -0.498 0 O-C-N 123.0 -0.118 . . . . 0.0 110.756 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 57.8 t -105.14 104.18 16.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.65 0.262 . . . . 0.0 110.53 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.515 ' CD1' ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -62.33 -26.89 68.68 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 179.345 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . 0.473 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 172.44 -171.57 44.37 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.121 -1.037 . . . . 0.0 113.181 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.461 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -145.79 147.68 32.13 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.664 -0.268 . . . . 0.0 110.704 -179.671 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.479 ' HA2' ' HG2' ' B' ' 426' ' ' ARG . . . -140.72 150.36 21.64 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 119.9 -1.143 . . . . 0.0 112.936 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . 0.457 ' CG2' ' HB ' ' B' ' 401' ' ' ILE . 1.6 p -152.02 137.3 10.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.788 0.327 . . . . 0.0 111.355 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.545 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -149.74 177.36 27.93 Favored Glycine 0 C--O 1.226 -0.344 0 C-N-CA 120.856 -0.688 . . . . 0.0 111.962 179.676 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.527 ' N ' HD11 ' B' ' 422' ' ' ILE . 4.4 ptt85 -85.5 -45.52 11.72 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -179.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.663 ' O ' ' N ' ' B' ' 421' ' ' LYS . 14.8 t30 -98.85 39.68 1.25 Allowed 'General case' 0 C--O 1.223 -0.332 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.589 ' O ' ' N ' ' B' ' 423' ' ' ALA . 1.0 OUTLIER 46.34 -47.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 179.069 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.663 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -42.35 -58.22 2.28 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 118.378 0.536 . . . . 0.0 109.893 -179.081 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.615 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.1 OUTLIER -46.69 -17.57 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.567 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.916 178.246 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.589 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -86.49 -49.84 7.29 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -57.33 -46.48 91.75 Favored Glycine 0 C--N 1.34 0.774 0 C-N-CA 119.824 -1.179 . . . . 0.0 110.781 178.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . 0.493 ' CD1' ' N ' ' B' ' 425' ' ' ILE . 1.3 mp -66.55 -65.0 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.068 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.615 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -39.7 -31.62 0.11 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.045 178.691 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.479 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -63.7 -59.88 4.02 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.462 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.609 ' CB ' ' CB ' ' B' ' 370' ' ' ALA . . . -58.95 -54.32 48.43 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 178.296 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.573 ' O ' ' CD2' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -53.12 -18.09 1.97 Allowed 'General case' 0 C--N 1.334 -0.076 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.339 178.602 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.525 ' ND2' ' O ' ' B' ' 426' ' ' ARG . 0.7 OUTLIER -82.07 -36.39 27.7 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.311 178.985 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.498 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -71.15 -37.17 72.25 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -178.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.573 ' CD2' ' O ' ' B' ' 429' ' ' GLU . 0.0 OUTLIER -83.85 12.2 6.44 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.044 179.968 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -99.17 -8.98 24.34 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.389 -179.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . 0.483 ' O ' ' HG ' ' B' ' 438' ' ' LEU . 29.8 t0 -108.68 87.36 2.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.068 0.461 . . . . 0.0 111.203 -179.602 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.568 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -53.0 -53.15 54.4 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.088 -179.963 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.568 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 7.5 mttm -52.15 -46.72 65.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.99 -179.597 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.482 ' O ' ' HB3' ' B' ' 440' ' ' PHE . 14.3 tmm? -68.4 -50.85 49.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.979 0.419 . . . . 0.0 110.338 179.476 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' B' ' 434' ' ' ASP . 58.3 mt -51.73 -62.37 1.67 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.546 179.419 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . 0.459 ' O ' ' HB3' ' B' ' 442' ' ' ALA . 48.9 t0 -57.37 -39.18 75.48 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.232 178.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.482 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.0 OUTLIER -45.94 -49.76 15.43 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.189 179.497 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.472 ' CE2' ' CE2' ' B' ' 440' ' ' PHE . 60.8 m-85 -65.15 -37.42 87.34 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.504 179.313 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . 0.507 ' O ' ' N ' ' B' ' 445' ' ' ARG . . . -45.52 -62.07 1.43 Allowed 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 178.23 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -48.36 -47.66 37.07 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 178.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . 0.451 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 2.5 mm100 -65.67 -5.7 9.23 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.046 178.802 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.531 ' HD3' ' CB ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -89.51 -42.25 11.57 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.1 179.79 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -71.46 -31.14 66.82 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.986 179.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.409 179.825 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 366' ' ' LEU . . . . . 0.475 HD12 ' HB3' ' B' ' 367' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.455 -0.215 0 CA-C-O 120.71 0.29 . . . . 0.0 110.34 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.475 ' HB3' HD12 ' B' ' 366' ' ' LEU . 30.0 t70 -41.93 -77.45 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.426 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.559 ' HA ' ' CD ' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -36.11 -41.72 0.27 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.52 179.414 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . 0.525 ' N ' ' HG3' ' B' ' 368' ' ' MET . 2.8 m-80 -63.96 -45.82 87.41 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.034 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.645 ' O ' ' N ' ' B' ' 373' ' ' GLN . . . -61.92 -68.53 0.31 Allowed 'General case' 0 C--O 1.223 -0.322 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 179.441 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.559 ' CD ' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -35.64 -44.89 0.34 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.795 0.331 . . . . 0.0 110.547 179.946 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.556 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.0 OUTLIER -64.64 -36.03 82.92 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-O 121.329 0.585 . . . . 0.0 110.247 179.209 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.645 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -62.51 -46.1 89.95 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.98 179.46 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.596 ' N ' ' CD2' ' B' ' 374' ' ' LEU . 0.1 OUTLIER -71.71 -65.73 0.72 Allowed 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -178.126 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . 0.631 ' CE1' ' CD1' ' B' ' 385' ' ' LEU . 2.5 m-85 -78.96 -7.25 57.87 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.337 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.556 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.2 OUTLIER -128.2 4.13 5.79 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.851 0.686 . . . . 0.0 112.851 -179.12 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.506 ' HB3' ' O ' ' B' ' 373' ' ' GLN . 49.4 tp -152.52 -2.74 0.25 Allowed 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -179.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.563 ' HB ' ' CB ' ' B' ' 441' ' ' TYR . 0.7 OUTLIER -131.52 -51.93 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.101 0 C-N-CA 119.442 -0.903 . . . . 0.0 112.324 179.602 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.539 ' N ' HD12 ' B' ' 378' ' ' ILE . . . -114.36 -151.45 10.36 Favored Glycine 0 N--CA 1.445 -0.765 0 C-N-CA 119.529 -1.32 . . . . 0.0 113.607 -179.117 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.481 ' CD1' ' C ' ' B' ' 379' ' ' GLY . 0.1 OUTLIER -155.09 -84.47 0.06 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.175 -0.513 . . . . 0.0 110.124 -179.389 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -170.59 25.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.692 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 382' ' ' SER . . . . . 0.471 ' O ' ' HG2' ' B' ' 384' ' ' ARG . 0.1 OUTLIER -131.73 -43.71 0.99 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.668 0.27 . . . . 0.0 111.034 179.874 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.526 HD23 ' CA ' ' B' ' 379' ' ' GLY . 1.1 pp -61.32 -15.01 31.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.949 0.404 . . . . 0.0 110.772 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . 0.471 ' HG2' ' O ' ' B' ' 382' ' ' SER . 15.0 mmt180 70.1 66.93 0.22 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.693 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.631 ' CD1' ' CE1' ' B' ' 375' ' ' TYR . 0.0 OUTLIER -102.12 132.8 47.8 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.88 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . 0.501 ' N ' HD21 ' B' ' 385' ' ' LEU . 30.8 p-80 -176.31 -177.39 0.86 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.627 0.727 . . . . 0.0 112.684 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.575 ' CE2' ' HB3' ' B' ' 404' ' ' CYS . 2.6 m-85 -118.96 165.18 14.41 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-N 114.749 -1.114 . . . . 0.0 110.156 178.617 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . 0.414 HG21 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -149.62 112.3 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 CA-C-O 121.484 0.659 . . . . 0.0 112.047 179.388 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 13.2 m -72.76 130.01 39.51 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.974 179.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.53 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 29.6 m -136.96 153.22 29.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.985 -179.672 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.53 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 86.16 28.47 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.351 -179.406 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.507 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.8 OUTLIER -8.58 119.06 0.03 OUTLIER Pre-proline 0 N--CA 1.467 0.41 0 O-C-N 124.148 0.905 . . . . 0.0 112.587 -179.717 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.5 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 2.0 Cg_endo -49.09 167.68 0.13 Allowed 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.703 2.269 . . . . 0.0 112.591 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 394' ' ' THR . . . . . 0.466 HG22 ' O ' ' B' ' 393' ' ' PRO . 52.2 p -150.33 158.86 44.62 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.39 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -77.65 5.7 8.72 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 120.962 0.41 . . . . 0.0 111.139 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 15.2 m -133.22 12.98 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.535 0.683 . . . . 0.0 109.387 178.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 174.22 56.93 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.004 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.51 ' O ' ' C ' ' B' ' 399' ' ' ASN . 60.0 Cg_exo -35.72 -57.1 0.54 Allowed 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 123.081 2.52 . . . . 0.0 112.71 -179.899 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.542 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 2.0 m-20 -13.52 125.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.924 -179.404 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 38.7 t -132.33 142.37 49.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.781 179.199 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.53 HD12 ' CG2' ' B' ' 416' ' ' VAL . 0.1 OUTLIER -109.6 134.13 52.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-O 121.104 0.478 . . . . 0.0 111.328 -179.366 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.465 ' O ' ' OG1' ' B' ' 414' ' ' THR . 2.0 t -98.16 154.73 3.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.76 179.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.414 ' CB ' HG21 ' B' ' 388' ' ' VAL . 8.4 mm-40 -130.7 104.29 7.1 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.367 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.575 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -92.5 107.22 19.05 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.659 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.508 ' HA ' ' O ' ' B' ' 410' ' ' THR . 10.5 ptm180 -147.21 164.95 31.52 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.894 -179.423 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.549 ' CG1' HD21 ' B' ' 385' ' ' LEU . 1.6 m -144.2 144.44 22.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.01 -179.544 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 68.56 3.86 35.66 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.42 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 67.11 12.31 8.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.704 0.288 . . . . 0.0 110.799 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -133.68 -5.19 2.91 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.474 -0.869 . . . . 0.0 113.239 -179.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.508 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 63.8 m -130.06 122.98 29.4 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-N 116.992 0.396 . . . . 0.0 111.935 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 9.6 t -107.26 96.07 4.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.834 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.47 ' CD1' ' SD ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -54.53 -21.86 11.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.011 0.434 . . . . 0.0 110.301 179.648 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 160.12 -161.51 32.52 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.69 -0.766 . . . . 0.0 112.299 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 414' ' ' THR . . . . . 0.47 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 8.8 t -160.25 167.68 27.03 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.121 0.486 . . . . 0.0 111.471 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.512 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -141.3 154.61 24.69 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.654 -0.784 . . . . 0.0 113.582 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . 0.53 ' CG2' HD12 ' B' ' 401' ' ' ILE . 85.9 t -148.15 100.86 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 120.761 0.315 . . . . 0.0 110.777 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.542 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -113.95 162.53 12.36 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.626 -0.797 . . . . 0.0 111.768 179.756 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.502 ' N ' HD13 ' B' ' 422' ' ' ILE . 0.0 OUTLIER -83.38 -50.68 8.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 117.125 0.462 . . . . 0.0 111.027 179.994 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.65 ' O ' ' CG2' ' B' ' 420' ' ' ILE . 0.5 OUTLIER -80.01 -23.93 41.17 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 120.972 -0.291 . . . . 0.0 110.767 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.65 ' CG2' ' O ' ' B' ' 419' ' ' ASN . 1.2 pp 110.54 -39.77 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 124.523 1.129 . . . . 0.0 110.842 -179.631 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.501 ' O ' ' N ' ' B' ' 424' ' ' GLY . 0.3 OUTLIER -45.86 -63.08 1.06 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.994 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.539 ' O ' ' CG ' ' B' ' 426' ' ' ARG . 0.1 OUTLIER -45.34 -24.45 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.282 177.316 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.569 ' CB ' ' O ' ' B' ' 420' ' ' ILE . . . -72.75 -51.76 17.81 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.092 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . 0.501 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -64.0 -54.6 29.41 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.25 -0.976 . . . . 0.0 111.322 179.341 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . 0.455 HG23 ' OE2' ' B' ' 429' ' ' GLU . 2.1 mm -62.6 -71.08 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.575 0 CA-C-N 115.662 -0.269 . . . . 0.0 111.113 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.539 ' CG ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -46.34 -25.4 0.63 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.944 0.402 . . . . 0.0 110.83 -178.549 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.534 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -62.56 -54.58 37.64 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 176.576 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.547 ' CB ' ' HB2' ' B' ' 370' ' ' ALA . . . -53.59 -50.84 64.76 Favored 'General case' 0 C--O 1.243 0.753 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 177.62 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.528 ' HA ' HD23 ' B' ' 432' ' ' LEU . 29.2 mt-10 -61.38 -8.54 4.08 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 115.085 -0.962 . . . . 0.0 111.402 179.168 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.534 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 24.8 m120 -86.48 -39.6 16.12 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.537 178.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.561 ' CB ' ' OH ' ' B' ' 387' ' ' TYR . . . -70.87 -34.39 71.56 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 -179.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.591 ' C ' ' CD2' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -85.82 14.51 5.86 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.383 -0.527 . . . . 0.0 111.356 -179.897 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 8.2 ttt180 -94.89 -3.71 48.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.178 -179.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . 0.526 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 18.2 m-20 -113.59 73.1 0.8 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.328 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.555 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 6.5 ptmt -41.89 -52.65 4.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.856 0.36 . . . . 0.0 110.579 179.713 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.555 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 1.4 mtpp -55.87 -45.17 78.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.212 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.526 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 15.5 tmm? -65.82 -52.3 51.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.082 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.484 HD22 ' NE2' ' B' ' 373' ' ' GLN . 24.3 mt -53.62 -65.37 0.58 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.617 179.297 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -46.51 -49.09 18.99 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.731 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.534 ' CE2' ' CZ ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -48.37 -42.23 31.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.532 0.682 . . . . 0.0 109.377 179.999 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.563 ' CB ' ' HB ' ' B' ' 378' ' ' ILE . 45.4 m-85 -73.02 -37.88 66.76 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.2 179.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -51.7 -59.47 4.25 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 3.4 ttmt -49.08 -45.24 42.82 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . 0.479 ' HB2' ' O ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -54.11 -49.04 70.04 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.058 178.543 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.72 -27.71 63.21 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.048 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -74.83 -41.61 59.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.976 0.417 . . . . 0.0 110.509 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.124 -179.933 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 366' ' ' LEU . . . . . 0.507 ' O ' ' HB2' ' B' ' 369' ' ' ASN . 6.7 tp . . . . . 0 N--CA 1.452 -0.326 0 CA-C-O 121.157 0.503 . . . . 0.0 110.982 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 367' ' ' ASP . . . . . 0.486 ' HB3' HG13 ' B' ' 425' ' ' ILE . 1.0 OUTLIER -46.84 -72.86 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 179.133 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 368' ' ' MET . . . . . 0.511 ' HE2' ' N ' ' B' ' 369' ' ' ASN . 3.5 tmm? -34.41 -42.48 0.14 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.773 179.591 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 369' ' ' ASN . . . . . 0.511 ' N ' ' HE2' ' B' ' 368' ' ' MET . 90.7 m-20 -59.99 -50.5 73.49 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.8 0.333 . . . . 0.0 110.704 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 370' ' ' ALA . . . . . 0.56 ' O ' ' N ' ' B' ' 373' ' ' GLN . . . -56.38 -68.31 0.22 Allowed 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 178.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 371' ' ' LYS . . . . . 0.425 ' C ' ' O ' ' B' ' 370' ' ' ALA . 2.5 mttm -33.85 -51.3 0.4 Allowed 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.9 179.809 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 372' ' ' ARG . . . . . 0.591 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.2 OUTLIER -56.64 -38.33 71.98 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.712 -179.843 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 373' ' ' GLN . . . . . 0.56 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -62.87 -57.14 11.85 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.696 0.76 . . . . 0.0 110.159 178.955 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 374' ' ' LEU . . . . . 0.579 ' CD1' ' CB ' ' B' ' 428' ' ' ALA . 1.8 mt -48.8 -74.75 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 1.5 m-30 -98.14 4.39 49.05 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 -176.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 376' ' ' SER . . . . . 0.591 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.1 OUTLIER -116.2 -2.04 12.26 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.077 0.465 . . . . 0.0 110.211 178.705 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 377' ' ' LEU . . . . . 0.53 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 0.4 OUTLIER -133.42 -39.04 0.92 Allowed 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.082 177.901 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 378' ' ' ILE . . . . . 0.437 HD11 ' HB3' ' B' ' 377' ' ' LEU . 0.7 OUTLIER -127.15 -142.79 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.672 179.501 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 379' ' ' GLY . . . . . 0.51 ' O ' ' O ' ' B' ' 380' ' ' TYR . . . 93.26 -22.62 33.85 Favored Glycine 0 C--N 1.332 0.342 0 C-N-CA 120.535 -0.84 . . . . 0.0 113.139 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 380' ' ' TYR . . . . . 0.619 ' CD2' ' HB3' ' B' ' 383' ' ' LEU . 0.2 OUTLIER 36.93 -175.23 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 115.258 1.577 . . . . 0.0 115.258 179.57 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -123.42 -21.46 5.31 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 113.734 -1.575 . . . . 0.0 111.183 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 37.9 t -160.14 44.84 0.22 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.136 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 383' ' ' LEU . . . . . 0.619 ' HB3' ' CD2' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -114.05 -3.99 13.24 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.861 0.362 . . . . 0.0 111.018 178.749 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 384' ' ' ARG . . . . . 0.507 ' O ' ' HA ' ' B' ' 406' ' ' VAL . 11.9 tpt180 75.86 71.63 0.08 Allowed 'General case' 0 C--O 1.227 -0.127 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 178.327 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 385' ' ' LEU . . . . . 0.517 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 7.3 tt -135.32 123.88 23.57 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.451 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 7.5 p-80 -158.91 146.17 17.47 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 -178.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 387' ' ' TYR . . . . . 0.58 ' CE1' ' SG ' ' B' ' 404' ' ' CYS . 39.2 m-85 -96.56 132.77 41.82 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 114.095 -1.411 . . . . 0.0 110.823 178.172 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 388' ' ' VAL . . . . . 0.448 HG21 ' O ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -122.17 130.82 74.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.52 179.575 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.1 m -91.96 121.17 33.3 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.291 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 390' ' ' VAL . . . . . 0.54 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 27.5 m -128.9 152.35 36.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.309 -179.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 391' ' ' LYS . . . . . 0.542 ' O ' ' C ' ' B' ' 392' ' ' LYS . 4.7 tmtt? 87.66 24.87 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.311 179.572 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 392' ' ' LYS . . . . . 0.542 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.2 OUTLIER -4.72 116.95 0.02 OUTLIER Pre-proline 0 N--CA 1.473 0.696 0 O-C-N 124.016 0.822 . . . . 0.0 111.962 -179.964 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 393' ' ' PRO . . . . . 0.54 ' CG ' HG22 ' B' ' 420' ' ' ILE . 15.7 Cg_exo -65.35 162.03 35.31 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.351 2.034 . . . . 0.0 112.542 -179.345 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 394' ' ' THR . . . . . 0.47 ' O ' ' HD3' ' B' ' 398' ' ' PRO . 2.3 p -150.08 164.82 34.56 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.478 -0.783 . . . . 0.0 112.022 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -81.6 5.29 18.57 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.603 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 396' ' ' VAL . . . . . 0.465 ' O ' ' HB3' ' B' ' 397' ' ' ASP . 26.1 m -123.41 11.54 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 CA-C-O 121.53 0.681 . . . . 0.0 109.462 178.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 397' ' ' ASP . . . . . 0.465 ' HB3' ' O ' ' B' ' 396' ' ' VAL . 2.0 p30 163.95 59.33 0.0 OUTLIER Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 114.803 -1.089 . . . . 0.0 109.841 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 398' ' ' PRO . . . . . 0.535 ' CB ' ' O ' ' B' ' 418' ' ' ARG . 21.5 Cg_exo -32.91 -57.4 0.31 Allowed 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 123.069 2.513 . . . . 0.0 112.368 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 399' ' ' ASN . . . . . 0.52 ' C ' ' O ' ' B' ' 398' ' ' PRO . 15.7 m120 -5.23 120.77 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 114.948 -1.023 . . . . 0.0 112.256 179.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 400' ' ' SER . . . . . 0.511 ' CB ' ' HG3' ' B' ' 393' ' ' PRO . 0.3 OUTLIER -144.15 139.4 28.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.886 179.949 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 401' ' ' ILE . . . . . 0.49 HG13 ' N ' ' B' ' 402' ' ' VAL . 1.9 tp -110.34 143.46 20.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.717 -179.537 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 402' ' ' VAL . . . . . 0.513 ' CG2' ' C ' ' B' ' 423' ' ' ALA . 0.4 OUTLIER -112.78 148.99 15.41 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.651 -179.568 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 403' ' ' GLU . . . . . 0.468 ' HA ' ' O ' ' B' ' 413' ' ' GLY . 2.1 mm-40 -127.74 128.72 45.86 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.745 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 404' ' ' CYS . . . . . 0.58 ' SG ' ' CE1' ' B' ' 387' ' ' TYR . 18.7 t -118.85 104.86 10.94 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 177.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . 0.463 ' HA ' ' O ' ' B' ' 410' ' ' THR . 3.1 ttp180 -110.96 158.2 19.03 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 124.126 0.891 . . . . 0.0 111.666 -178.3 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 406' ' ' VAL . . . . . 0.517 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -154.7 159.62 3.0 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.668 -179.6 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 64.93 -94.82 0.18 Allowed Glycine 0 CA--C 1.518 0.259 0 CA-C-N 115.173 -0.921 . . . . 0.0 113.211 179.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -141.61 20.55 2.19 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 111.555 0.206 . . . . 0.0 111.555 -179.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 151.82 -14.46 0.79 Allowed Glycine 0 C--N 1.33 0.195 0 C-N-CA 120.234 -0.984 . . . . 0.0 112.96 179.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 410' ' ' THR . . . . . 0.472 ' HB ' HG22 ' B' ' 406' ' ' VAL . 95.0 m -53.58 108.77 0.37 Allowed 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 411' ' ' VAL . . . . . 0.462 HG23 ' HB2' ' B' ' 405' ' ' ARG . 24.2 t -124.07 106.61 17.21 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.742 0 CA-C-O 122.006 0.908 . . . . 0.0 111.523 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . 0.455 ' O ' ' HB3' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -102.62 -38.99 7.26 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 113.704 -1.589 . . . . 0.0 108.942 -179.878 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 413' ' ' GLY . . . . . 0.56 ' HA3' ' HB3' ' B' ' 404' ' ' CYS . . . -72.23 98.64 0.82 Allowed Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.069 -1.062 . . . . 0.0 112.535 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 414' ' ' THR . . . . . . . . . . . . . 3.7 m -134.79 93.68 3.06 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 415' ' ' GLY . . . . . 0.527 ' CA ' ' HG2' ' B' ' 426' ' ' ARG . . . -133.71 147.3 18.99 Favored Glycine 0 C--O 1.226 -0.363 0 C-N-CA 119.523 -1.322 . . . . 0.0 114.394 -178.485 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 10.5 p -127.87 154.1 38.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.312 -0.444 . . . . 0.0 110.173 179.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . 0.502 ' HA3' ' CD1' ' B' ' 422' ' ' ILE . . . -165.1 155.72 27.27 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 119.948 -1.12 . . . . 0.0 113.039 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 418' ' ' ARG . . . . . 0.535 ' O ' ' CB ' ' B' ' 398' ' ' PRO . 0.0 OUTLIER -70.77 -41.98 71.0 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.867 0.365 . . . . 0.0 111.361 -179.939 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 419' ' ' ASN . . . . . 0.534 ' OD1' ' N ' ' B' ' 419' ' ' ASN . 0.1 OUTLIER -100.36 23.97 9.46 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.184 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 420' ' ' ILE . . . . . 0.578 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 56.51 -43.09 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 179.247 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 421' ' ' LYS . . . . . 0.617 ' CD ' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -45.17 -57.71 3.74 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 179.282 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 422' ' ' ILE . . . . . 0.617 ' N ' ' CD ' ' B' ' 421' ' ' LYS . 0.0 OUTLIER -45.78 -26.76 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.56 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.601 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . 0.578 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -77.26 -47.92 18.85 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 177.233 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 424' ' ' GLY . . . . . 0.565 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -57.89 -53.48 45.02 Favored Glycine 0 N--CA 1.447 -0.58 0 N-CA-C 110.058 -1.217 . . . . 0.0 110.058 178.079 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 425' ' ' ILE . . . . . 0.486 HG13 ' HB3' ' B' ' 367' ' ' ASP . 0.7 OUTLIER -59.15 -67.67 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 177.653 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 426' ' ' ARG . . . . . 0.567 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 3.5 tpt180 -35.86 -33.76 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.201 179.213 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 427' ' ' ALA . . . . . 0.47 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -63.33 -58.17 7.98 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.512 178.478 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 428' ' ' ALA . . . . . 0.579 ' CB ' ' CD1' ' B' ' 374' ' ' LEU . . . -58.25 -53.87 53.35 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 178.476 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 429' ' ' GLU . . . . . 0.455 ' HA ' HD23 ' B' ' 432' ' ' LEU . 1.1 tt0 -49.14 -25.02 1.9 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.365 178.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 430' ' ' ASN . . . . . 0.47 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 2.4 m-80 -78.34 -36.89 45.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.477 179.114 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 431' ' ' ALA . . . . . 0.497 ' O ' ' CE ' ' B' ' 437' ' ' MET . . . -67.73 -41.77 82.94 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.487 -179.372 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 432' ' ' LEU . . . . . 0.562 ' HA ' ' CD2' ' B' ' 438' ' ' LEU . 0.6 OUTLIER -81.05 6.88 12.24 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.041 -179.839 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.47 -10.75 59.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.711 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 434' ' ' ASP . . . . . 0.459 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 0.8 OUTLIER -126.25 89.95 3.1 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.609 -0.437 . . . . 0.0 112.009 -178.991 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 435' ' ' LYS . . . . . 0.561 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 12.4 ptmt -53.79 -51.36 63.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.2 179.198 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 436' ' ' LYS . . . . . 0.561 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -51.95 -36.23 48.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.144 179.834 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 437' ' ' MET . . . . . 0.497 ' CE ' ' O ' ' B' ' 431' ' ' ALA . 14.9 tmm? -76.75 -50.47 13.5 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.944 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 438' ' ' LEU . . . . . 0.562 ' CD2' ' HA ' ' B' ' 432' ' ' LEU . 23.0 mt -53.02 -64.04 0.95 Allowed 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.735 0.779 . . . . 0.0 110.162 178.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 439' ' ' ASP . . . . . 0.525 ' O ' ' N ' ' B' ' 442' ' ' ALA . 6.1 t70 -50.55 -50.04 54.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.736 179.11 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 440' ' ' PHE . . . . . 0.41 ' HB3' ' O ' ' B' ' 436' ' ' LYS . 0.1 OUTLIER -43.03 -38.58 2.35 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.777 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 441' ' ' TYR . . . . . 0.526 ' O ' ' CG ' ' B' ' 444' ' ' GLN . 48.1 m-85 -74.33 -31.43 62.44 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.863 179.456 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 442' ' ' ALA . . . . . 0.525 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -59.01 -60.65 3.53 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 177.451 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.9 -37.47 19.84 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 178.104 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 444' ' ' GLN . . . . . 0.645 ' HG3' ' N ' ' B' ' 445' ' ' ARG . 0.0 OUTLIER -62.17 -47.14 85.82 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.384 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 445' ' ' ARG . . . . . 0.645 ' N ' ' HG3' ' B' ' 444' ' ' GLN . 0.0 OUTLIER -50.06 -35.1 23.77 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.083 179.589 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -86.63 -39.95 15.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.481 -179.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.912 -179.275 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.509 " O2'" " O5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.183 0 O4'-C1'-N19 111.397 3.197 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.597 ' C6 ' ' C5 ' ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.222 0 O4'-C1'-N19 110.982 2.782 . 0.062 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.62 " O2'" " C5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.714 0 C3'-C2'-C1' 104.838 3.709 . 0.048 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.62 " C5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.068 0 O4'-C1'-N19 111.298 3.098 . 0.103 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.545 " C5'" HO2' ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.189 0 O4'-C1'-N19 111.162 2.962 . 0.091 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.502 " O2'" " H5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.218 0 O4'-C1'-N19 111.294 3.094 . 0.218 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.682 ' H6 ' " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.993 0 O4'-C1'-N19 111.313 3.113 . 0.373 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.549 ' N4 ' ' C4 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.286 0 O4'-C1'-N19 110.971 2.771 . 0.241 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.438 " H2'" ' C6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.19 0 O4'-C1'-N19 111.249 3.049 . 0.087 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.642 " O2'" " C5'" ' A' ' 11' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.438 1.97 0 O4'-C1'-N19 111.124 2.924 . 0.369 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.642 " C5'" " O2'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.303 0 O4'-C1'-N19 111.114 2.914 . 0.076 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.799 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.436 1.802 0 O4'-C1'-N19 111.147 2.947 . 0.017 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.799 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.169 0 O4'-C1'-N19 111.6 3.4 . 0.023 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.705 ' C5 ' ' C8 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -2.041 0 C5'-C4'-C3' 111.191 -2.873 . 0.064 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.705 ' C8 ' ' C5 ' ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.429 -2.033 0 C5'-C4'-C3' 110.685 -3.21 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.7 ' C8 ' ' C6 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.433 -1.65 0 C5'-C4'-C3' 110.762 -3.158 . 0.35 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.567 " O2'" " O4'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.887 0 C5'-C4'-C3' 111.16 -2.893 . 0.0 OUTLIER alpha 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.642 ' N3 ' ' CG ' ' B' ' 372' ' ' ARG . . . . . . . . 0 O4'--C1' 1.435 1.73 0 C5'-C4'-C3' 110.881 -3.079 . 0.079 2a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.62 " O4'" " C2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.281 0 O4'-C1'-N19 111.222 3.022 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.884 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 P--O5' 1.609 1.647 0 C5'-C4'-C3' 110.925 -3.05 . 0.264 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.884 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.685 0 C3'-C2'-C1' 104.603 3.448 . 0.012 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.939 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.436 1.852 0 O4'-C1'-N19 111.228 3.028 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.838 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.145 0 C5'-C4'-C3' 111.333 -2.778 . 0.031 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.695 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.36 0 O4'-C1'-N19 111.453 3.253 . 0.185 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.575 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.301 0 O4'-C1'-N19 111.066 2.866 . 0.178 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.575 ' C6 ' ' C6 ' ' A' ' 25' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.569 0 O4'-C1'-N19 111.097 2.897 . 0.117 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.875 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.024 0 O4'-C1'-N19 111.146 2.946 . 0.113 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.875 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.532 0 C3'-C2'-C1' 104.401 3.223 . 0.028 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.933 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.196 0 O4'-C1'-N19 111.254 3.054 . 0.176 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 1.0 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.356 0 O4'-C1'-N19 111.533 3.333 . 0.29 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 1.0 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.597 0 O4'-C1'-N19 111.265 3.065 . 0.202 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . 0.638 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.538 0 C5'-C4'-C3' 111.077 -2.949 . 0.133 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.152 0 N-CA-C 112.547 -0.221 . . . . 0.0 112.547 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -142.17 78.31 1.62 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.769 0.319 . . . . 0.0 110.885 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . 0.516 HD23 ' N ' ' B' ' 366' ' ' LEU . 0.3 OUTLIER -159.81 159.92 33.2 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 179.942 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.484 ' O ' ' HG2' ' B' ' 371' ' ' LYS . 21.1 t70 26.12 -96.6 0.01 OUTLIER 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.344 -179.3 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.575 ' CE ' ' ND2' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -41.7 -56.24 2.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.553 179.773 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . 0.575 ' ND2' ' CE ' ' B' ' 368' ' ' MET . 3.1 m-80 -62.97 -34.39 77.41 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.566 ' HA ' ' CD2' ' B' ' 432' ' ' LEU . . . -62.59 -72.15 0.14 Allowed 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.852 179.176 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.515 ' HD2' HO2' ' A' ' 20' ' ' ' A' . 0.0 OUTLIER -39.15 -38.18 0.46 Allowed 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.648 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.642 ' CG ' ' N3 ' ' A' ' 18' ' ' ' A' . 0.6 OUTLIER -61.83 -46.47 89.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.234 179.259 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.507 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -60.98 -59.57 5.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.617 179.315 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.448 HD13 ' HB3' ' B' ' 428' ' ' ALA . 0.7 OUTLIER -46.36 -69.97 0.11 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.109 -0.951 . . . . 0.0 112.025 -179.464 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . 0.523 ' O ' ' N ' ' B' ' 379' ' ' GLY . 1.9 m-85 -72.03 -61.16 1.89 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -177.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.529 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.6 OUTLIER -55.58 -56.88 15.2 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -178.478 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.48 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.2 OUTLIER -72.2 -45.51 60.02 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -178.273 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.534 ' O ' ' CD1' ' B' ' 383' ' ' LEU . 11.3 mm -128.5 39.1 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.317 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' B' ' 375' ' ' TYR . . . -111.21 73.49 0.21 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.415 179.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.581 ' CD2' ' HD3' ' B' ' 445' ' ' ARG . 23.8 p90 -95.01 -164.64 1.19 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.669 0.271 . . . . 0.0 110.865 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . 0.575 ' O ' ' CE2' ' B' ' 380' ' ' TYR . . . -97.53 124.54 41.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.369 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 382' ' ' SER . . . . . 0.57 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 1.5 m 94.33 -10.93 0.12 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.97 179.253 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.534 ' CD1' ' O ' ' B' ' 378' ' ' ILE . 5.1 tt -45.49 -39.99 7.9 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.112 0.482 . . . . 0.0 110.532 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 13.9 tpt85 67.33 64.76 0.42 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.929 179.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.539 HD23 ' CE1' ' B' ' 387' ' ' TYR . 0.1 OUTLIER -58.45 157.46 8.82 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.347 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . 0.525 ' CB ' ' O ' ' B' ' 405' ' ' ARG . 0.0 OUTLIER -158.67 72.65 0.6 Allowed 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -178.822 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.579 ' CZ ' ' HB3' ' B' ' 404' ' ' CYS . 5.7 m-85 -86.67 95.56 9.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.849 0.357 . . . . 0.0 110.089 177.135 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . 0.506 HG21 ' CB ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -88.66 136.88 22.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.028 -179.7 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.2 m -97.12 126.43 42.29 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.084 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.522 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 28.0 m -132.33 153.21 37.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.5 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.545 ' O ' ' C ' ' B' ' 392' ' ' LYS . 6.6 tptt 87.3 21.87 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.501 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.545 ' C ' ' O ' ' B' ' 391' ' ' LYS . 6.7 mttp -8.72 122.41 0.02 OUTLIER Pre-proline 0 N--CA 1.472 0.647 0 O-C-N 123.839 0.712 . . . . 0.0 111.996 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.528 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 23.9 Cg_exo -62.83 163.04 23.17 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.787 2.325 . . . . 0.0 113.447 -178.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 394' ' ' THR . . . . . 0.523 ' CG2' ' OD1' ' B' ' 397' ' ' ASP . 0.1 OUTLIER -149.65 168.0 24.82 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.337 179.832 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -81.12 7.68 10.49 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.973 0.416 . . . . 0.0 111.159 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . 0.447 HG21 ' OG1' ' B' ' 394' ' ' THR . 5.2 m -129.26 13.59 2.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.425 0.631 . . . . 0.0 109.613 178.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . 0.523 ' OD1' ' CG2' ' B' ' 394' ' ' THR . 10.5 p30 163.51 63.12 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.382 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.528 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 75.9 Cg_exo -39.06 -51.35 2.5 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.852 2.368 . . . . 0.0 112.028 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.528 ' C ' ' O ' ' B' ' 398' ' ' PRO . 10.2 m120 -6.75 123.36 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.027 -0.988 . . . . 0.0 112.385 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 400' ' ' SER . . . . . 0.45 ' HB2' ' HG3' ' B' ' 393' ' ' PRO . 0.9 OUTLIER -140.49 137.97 34.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.581 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.528 HG13 ' N ' ' B' ' 402' ' ' VAL . 0.5 OUTLIER -114.26 141.73 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-O 120.995 0.426 . . . . 0.0 111.18 -179.769 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.528 ' N ' HG13 ' B' ' 401' ' ' ILE . 0.3 OUTLIER -107.87 152.41 9.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.277 -179.178 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.506 ' CB ' HG21 ' B' ' 388' ' ' VAL . 0.1 OUTLIER -115.63 98.91 6.97 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.217 178.931 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.579 ' HB3' ' CZ ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -78.43 92.32 4.59 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 179.325 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.581 ' HA ' ' O ' ' B' ' 410' ' ' THR . 5.7 ptp180 -139.14 157.45 45.93 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.498 -179.24 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.485 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 2.9 m -148.98 158.86 6.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.826 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 73.62 -1.61 43.96 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.82 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 14.6 t0 76.42 7.97 3.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.695 0.283 . . . . 0.0 111.246 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -157.76 17.61 0.34 Allowed Glycine 0 CA--C 1.519 0.338 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.92 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.581 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 0.2 OUTLIER -128.74 122.48 30.74 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 116.54 0.17 . . . . 0.0 111.044 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 36.0 t -113.21 103.45 15.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.602 0.239 . . . . 0.0 110.788 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.534 ' N ' ' CD1' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -67.79 -25.22 65.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.959 0.409 . . . . 0.0 110.024 179.546 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . 0.452 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 165.59 -165.36 37.89 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.313 -0.946 . . . . 0.0 112.843 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.473 ' CG2' ' O ' ' B' ' 402' ' ' VAL . 0.2 OUTLIER -150.68 157.41 42.93 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.657 0.265 . . . . 0.0 110.726 -179.766 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.48 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -149.73 152.29 24.26 Favored Glycine 0 C--O 1.226 -0.396 0 C-N-CA 120.044 -1.074 . . . . 0.0 113.226 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . 0.443 HG23 ' HB ' ' B' ' 401' ' ' ILE . 2.7 p -141.4 150.23 19.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.63 0.252 . . . . 0.0 110.898 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.536 ' HA3' ' CD1' ' B' ' 422' ' ' ILE . . . -163.0 161.34 33.81 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.445 -0.883 . . . . 0.0 112.608 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.524 ' N ' HD11 ' B' ' 422' ' ' ILE . 0.0 OUTLIER -74.92 -42.86 56.93 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.807 0.337 . . . . 0.0 111.31 -179.787 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.493 ' O ' HG13 ' B' ' 420' ' ' ILE . 0.7 OUTLIER -98.06 27.32 4.63 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.778 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.6 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 53.44 -44.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 178.903 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.626 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.6 OUTLIER -44.65 -56.8 4.09 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.975 -1.121 . . . . 0.0 107.975 179.867 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.626 ' N ' ' HD3' ' B' ' 421' ' ' LYS . 0.0 OUTLIER -46.29 -24.96 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.462 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 178.349 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.6 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -79.5 -48.74 13.38 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 177.434 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . 0.505 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -58.65 -52.82 50.78 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.284 -1.126 . . . . 0.0 110.284 178.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . 0.516 ' N ' HD12 ' B' ' 425' ' ' ILE . 3.3 mm -58.43 -67.22 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 177.638 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.58 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 7.6 tpt180 -36.32 -32.16 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.237 178.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.492 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -64.5 -55.13 22.7 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.431 178.553 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.526 ' O ' HD23 ' B' ' 432' ' ' LEU . . . -56.88 -55.7 31.11 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.44 178.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.495 ' HA ' ' CD2' ' B' ' 432' ' ' LEU . 0.7 OUTLIER -53.5 -21.3 6.05 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.45 179.148 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.7 OUTLIER -75.65 -41.32 54.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.257 179.03 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.478 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -67.25 -37.72 83.99 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.753 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.566 ' CD2' ' HA ' ' B' ' 370' ' ' ALA . 0.7 OUTLIER -83.9 9.57 11.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.716 0.293 . . . . 0.0 111.108 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -92.27 -11.72 34.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.245 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . 0.475 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 32.7 m-20 -109.25 71.71 0.78 Allowed 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 120.687 0.279 . . . . 0.0 111.219 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.57 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -45.84 -54.01 8.79 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.433 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.57 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 7.5 mttt -48.19 -40.46 24.2 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.57 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.577 ' HE3' ' CE2' ' B' ' 441' ' ' TYR . 0.4 OUTLIER -77.73 -41.03 39.15 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 178.973 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.456 ' O ' HD12 ' B' ' 378' ' ' ILE . 95.7 mt -56.17 -65.04 0.67 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.966 179.173 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . 0.494 ' O ' ' N ' ' B' ' 442' ' ' ALA . 21.5 t70 -55.92 -46.42 78.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.267 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.468 ' HB2' ' O ' ' B' ' 436' ' ' LYS . 8.2 t80 -41.97 -45.12 3.71 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.28 -0.873 . . . . 0.0 108.903 179.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.577 ' CE2' ' HE3' ' B' ' 437' ' ' MET . 16.6 m-30 -67.62 -37.56 82.67 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.487 178.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . 0.494 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -47.61 -61.77 1.77 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 178.285 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.83 -57.34 11.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.643 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.422 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -41.92 -62.88 0.82 Allowed 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.232 0.539 . . . . 0.0 110.36 179.011 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.581 ' HD3' ' CD2' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -43.22 -37.35 2.1 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.819 179.172 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -76.74 -41.05 46.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.919 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . 0.47 ' O ' ' O ' ' B' ' 448' ' ' ILE . . . -70.31 -72.07 0.22 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.322 -179.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.497 HG12 ' O ' ' B' ' 445' ' ' ARG . 0.1 OUTLIER 27.87 100.23 0.02 OUTLIER Pre-proline 0 N--CA 1.463 0.181 0 CA-C-N 116.031 -0.531 . . . . 0.0 112.029 -179.82 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -71.57 -169.05 0.39 Allowed 'Trans proline' 0 N--CA 1.464 -0.242 0 C-N-CA 122.912 2.408 . . . . 0.0 112.43 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -90.31 172.63 8.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.181 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 23.8 m 60.33 67.3 0.86 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.154 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -126.95 141.32 51.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.635 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 6.2 p . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.265 -0.874 . . . . 0.0 111.033 -179.791 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.768 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.436 1.837 0 C5'-C4'-C3' 111.19 -2.874 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.884 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.193 0 O4'-C1'-N19 111.345 3.145 . 0.326 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.884 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.175 0 O4'-C1'-N19 111.042 2.842 . 0.286 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.638 " C5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.271 0 C5'-C4'-C3' 111.229 -2.848 . 0.079 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.488 HO2' ' HB2' ' B' ' 393' ' ' PRO . . . . . . . . 0 O4'--C1' 1.441 2.217 0 O4'-C1'-N19 111.266 3.066 . 0.203 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.447 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.239 0 O4'-C1'-N19 111.065 2.865 . 0.153 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.529 ' H6 ' " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.002 0 O4'-C1'-N19 111.504 3.304 . 0.169 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.632 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.442 2.312 0 O4'-C1'-N19 111.093 2.893 . 0.234 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.632 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.436 0 O4'-C1'-N19 111.111 2.911 . 0.305 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.607 ' H6 ' " O5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.437 1.902 0 O4'-C1'-N19 111.338 3.138 . 0.063 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.647 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.426 0 O4'-C1'-N19 111.05 2.85 . 0.058 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.89 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 P--O5' 1.612 1.863 0 C5'-C4'-C3' 111.19 -2.873 . 0.02 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.89 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.578 0 C3'-C2'-C1' 104.67 3.522 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.643 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.491 0 O4'-C1'-N19 111.295 3.095 . 0.209 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.693 ' C6 ' ' N7 ' ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.43 -1.894 0 C5'-C4'-C3' 110.908 -3.061 . 0.035 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.693 ' N7 ' ' C6 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.747 0 C5'-C4'-C3' 110.857 -3.096 . 0.522 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.686 " O2'" ' C8 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.22 0 C5'-C4'-C3' 110.817 -3.122 OUTLIER-EPSILON 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.686 ' C8 ' " O2'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.656 0 C5'-C4'-C3' 110.989 -3.007 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.587 " O2'" " O4'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.12 0 O4'-C1'-N19 111.274 3.074 . 0.186 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.731 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.77 0 O4'-C1'-N19 111.097 2.897 . 0.072 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.665 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.523 0 C3'-C2'-C1' 104.749 3.609 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.924 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.979 0 O4'-C1'-N19 111.317 3.117 . 0.01 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.73 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.211 0 O4'-C1'-N19 111.798 3.598 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.844 ' H6 ' " O5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 P--O5' 1.614 2.145 0 C5'-C4'-C3' 111.542 -2.639 . 0.058 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.441 2.289 0 O4'-C1'-N19 111.383 3.183 . 0.381 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.595 " O2'" " C5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.449 0 O4'-C1'-N19 111.222 3.022 . 0.162 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.702 ' H6 ' " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.033 0 O4'-C1'-N19 111.166 2.966 . 0.121 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.677 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.411 0 C3'-C2'-C1' 104.435 3.261 . 0.039 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.862 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.442 2.314 0 O4'-C1'-N19 111.133 2.933 . 0.166 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 0.966 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.268 0 O4'-C1'-N19 111.49 3.29 . 0.378 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 0.966 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.665 0 O4'-C1'-N19 111.411 3.211 . 0.224 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . 0.612 " H5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.414 0 C5'-C4'-C3' 111.331 -2.779 . 0.619 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.197 0 N-CA-C 112.493 -0.243 . . . . 0.0 112.493 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 365' ' ' SER . . . . . 0.566 ' HB3' ' P ' ' A' ' 15' ' ' ' A' . 23.1 t -80.69 57.33 2.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.768 0.318 . . . . 0.0 111.062 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . 0.411 HD11 ' HA ' ' B' ' 366' ' ' LEU . 2.8 tp -50.9 -19.67 1.08 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.347 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.54 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -45.67 -71.88 0.07 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.354 179.601 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.58 ' CE ' ' CB ' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -38.58 -35.48 0.19 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.14 -179.129 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . 0.58 ' CB ' ' CE ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -67.71 -39.38 84.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.027 0.441 . . . . 0.0 109.904 179.779 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.54 ' N ' ' O ' ' B' ' 367' ' ' ASP . . . -62.27 -69.99 0.22 Allowed 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.134 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.543 ' HE3' ' N ' ' B' ' 368' ' ' MET . 0.4 OUTLIER -37.23 -44.93 0.61 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.13 179.428 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.547 ' O ' ' CB ' ' B' ' 376' ' ' SER . 1.4 tmm_? -56.27 -40.68 74.63 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.897 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.517 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -64.26 -48.51 75.47 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.076 0.465 . . . . 0.0 111.273 179.871 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.529 ' CD2' HD22 ' B' ' 432' ' ' LEU . 0.3 OUTLIER -59.72 -70.18 0.17 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -178.128 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . 0.509 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 4.6 m-85 -72.51 -34.49 67.65 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -177.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.547 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -83.58 -54.96 4.56 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.561 -179.323 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.502 ' CB ' ' O ' ' B' ' 373' ' ' GLN . 0.2 OUTLIER -72.68 -35.84 67.77 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.625 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.507 HG13 HD23 ' B' ' 438' ' ' LEU . 3.9 mm -137.01 36.78 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -178.515 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.509 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -127.04 90.71 0.36 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.212 -0.994 . . . . 0.0 112.824 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.498 ' CE2' ' HG ' ' B' ' 383' ' ' LEU . 52.3 p90 -99.74 -160.08 0.78 Allowed 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.397 -0.223 . . . . 0.0 110.397 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . 0.539 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -93.61 123.03 36.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.8 0.333 . . . . 0.0 111.622 -179.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 382' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 3.2 m 87.78 -3.66 0.56 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.017 179.03 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.501 ' CD1' ' O ' ' B' ' 378' ' ' ILE . 6.2 tt -50.63 -43.67 57.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.807 0.337 . . . . 0.0 111.143 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . 0.464 ' O ' HG12 ' B' ' 406' ' ' VAL . 0.1 OUTLIER 69.84 74.09 0.23 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.674 -179.827 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.57 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 9.9 tt -118.68 128.95 55.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.124 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 41.1 p-80 -149.51 146.99 27.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.65 0.738 . . . . 0.0 112.85 -178.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.607 ' CZ ' ' HB3' ' B' ' 404' ' ' CYS . 2.8 m-85 -101.66 141.75 34.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.661 -1.154 . . . . 0.0 110.532 178.558 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -124.27 119.52 56.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.204 0.526 . . . . 0.0 110.777 179.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.8 m -80.12 122.99 27.49 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.817 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.563 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 31.5 m -131.86 161.01 42.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.76 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.563 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.2 OUTLIER 94.65 21.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.424 -179.908 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.533 ' O ' ' O ' ' B' ' 391' ' ' LYS . 0.7 OUTLIER 4.24 118.94 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.741 0 O-C-N 124.095 0.872 . . . . 0.0 112.829 179.742 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.5 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 7.0 Cg_exo -68.58 157.03 63.52 Favored 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.615 2.21 . . . . 0.0 113.586 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -137.24 171.77 13.99 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.472 -1.24 . . . . 0.0 111.981 -179.624 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -93.39 18.75 9.23 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-O 121.289 0.566 . . . . 0.0 110.442 179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 34.6 m -135.67 -0.53 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.195 178.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . 0.434 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 1.6 m-20 179.25 56.24 0.06 OUTLIER Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 114.871 -1.059 . . . . 0.0 108.852 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.5 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 73.7 Cg_exo -38.57 -35.75 0.51 Allowed 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 123.282 2.654 . . . . 0.0 112.902 -179.251 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.6 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -30.51 134.3 0.06 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.543 0.687 . . . . 0.0 112.212 -178.208 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 400' ' ' SER . . . . . 0.482 ' OG ' ' HG3' ' B' ' 393' ' ' PRO . 45.8 m -143.24 151.68 40.86 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.338 -179.681 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.539 ' CG2' HG21 ' B' ' 390' ' ' VAL . 10.2 tt -109.99 156.12 11.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.962 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.526 ' CG2' ' O ' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -121.19 152.98 24.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.641 -178.369 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.447 ' O ' ' HA ' ' B' ' 387' ' ' TYR . 2.8 mt-10 -121.24 122.6 40.29 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.764 178.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.607 ' HB3' ' CZ ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -109.97 108.1 18.23 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 179.163 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.503 ' HA ' ' O ' ' B' ' 410' ' ' THR . 1.2 ptm180 -134.58 -170.02 2.46 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.683 0.754 . . . . 0.0 112.713 -178.455 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.57 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -158.64 157.75 3.16 Favored 'Isoleucine or valine' 0 C--O 1.243 0.72 0 CA-C-N 114.492 -1.231 . . . . 0.0 112.003 -178.686 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 59.0 -95.08 0.06 OUTLIER Glycine 0 N--CA 1.448 -0.55 0 CA-C-N 114.737 -1.12 . . . . 0.0 111.957 -179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -167.08 27.1 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.753 0.311 . . . . 0.0 110.366 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 177.08 26.51 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 119.997 -1.097 . . . . 0.0 113.528 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.503 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 87.4 m -130.53 109.09 10.42 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 117.168 0.484 . . . . 0.0 110.815 178.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . 0.476 ' HA ' ' HA ' ' B' ' 405' ' ' ARG . 74.1 t -101.85 116.09 44.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.654 0.264 . . . . 0.0 110.521 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.515 ' N ' ' O ' ' B' ' 404' ' ' CYS . 0.4 OUTLIER -71.58 -35.38 70.53 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.411 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . 0.498 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 172.38 -176.07 45.42 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.15 -1.024 . . . . 0.0 112.875 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.44 ' O ' ' CG ' ' B' ' 430' ' ' ASN . 0.5 OUTLIER -145.7 155.94 43.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.728 0.299 . . . . 0.0 111.294 -179.369 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.537 ' HA3' ' CG ' ' B' ' 426' ' ' ARG . . . -149.41 135.48 5.36 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.301 -0.952 . . . . 0.0 112.686 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . 0.464 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 8.8 p -125.87 152.51 33.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.76 0.314 . . . . 0.0 110.506 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.6 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -159.95 167.24 35.33 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.503 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.535 ' CG ' ' OD1' ' B' ' 419' ' ' ASN . 7.4 ptm180 -71.23 -41.92 69.53 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -179.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.535 ' OD1' ' CG ' ' B' ' 418' ' ' ARG . 0.3 OUTLIER -107.28 34.15 3.64 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.673 0.273 . . . . 0.0 110.802 179.575 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.579 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.7 OUTLIER 55.99 -42.57 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 179.292 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.536 ' N ' HG13 ' B' ' 420' ' ' ILE . 0.0 OUTLIER -45.0 -61.47 1.61 Allowed 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 118.954 0.797 . . . . 0.0 109.721 -179.795 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.594 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.0 OUTLIER -45.31 -21.9 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 177.851 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.579 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -86.19 -50.53 6.91 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.595 178.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -57.46 -42.52 93.9 Favored Glycine 0 C--N 1.337 0.624 0 C-N-CA 120.083 -1.056 . . . . 0.0 110.998 179.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . 0.538 ' CD1' ' N ' ' B' ' 425' ' ' ILE . 0.6 OUTLIER -71.16 -63.38 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.237 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.594 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 12.2 tpt180 -41.37 -31.29 0.23 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.681 178.373 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.509 ' CB ' ' HB ' ' B' ' 402' ' ' VAL . . . -64.51 -60.35 3.24 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.449 178.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.535 ' HB2' ' CB ' ' B' ' 370' ' ' ALA . . . -57.84 -51.9 67.68 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.54 ' O ' ' HB2' ' B' ' 433' ' ' ARG . 79.7 mm-40 -55.33 -21.59 15.61 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.079 178.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.505 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.6 OUTLIER -76.71 -38.81 53.7 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.138 178.881 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.485 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -62.42 -32.68 73.56 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.328 0.585 . . . . 0.0 109.49 179.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.535 ' CD2' ' O ' ' B' ' 428' ' ' ALA . 0.2 OUTLIER -96.99 3.63 51.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.071 178.709 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . 0.54 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 0.0 OUTLIER -89.89 19.72 4.65 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.795 -179.964 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . 0.514 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 15.5 m-20 -136.19 80.67 1.84 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.384 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.576 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.3 OUTLIER -47.18 -57.25 5.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.211 -179.905 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.576 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 2.5 mtmt -49.3 -42.49 41.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.28 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.514 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 0.5 OUTLIER -70.49 -50.31 39.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.585 179.603 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.507 HD23 HG13 ' B' ' 378' ' ' ILE . 85.4 mt -50.78 -59.58 3.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.469 0.652 . . . . 0.0 110.489 179.402 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -59.09 -42.66 90.99 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.47 178.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.505 ' CD1' ' C ' ' B' ' 440' ' ' PHE . 0.1 OUTLIER -42.81 -48.96 5.8 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 179.368 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.456 ' O ' ' C ' ' B' ' 442' ' ' ALA . 55.1 m-85 -62.57 -46.3 88.98 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.56 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . 0.456 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -39.12 -61.69 0.73 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 178.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 1.4 tmtt? -49.47 -49.92 43.47 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 178.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.528 ' O ' ' N ' ' B' ' 447' ' ' ALA . 0.0 OUTLIER -51.04 -59.01 4.62 Favored 'General case' 0 C--N 1.334 -0.085 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 178.878 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.478 ' HD3' ' HB3' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -38.1 -41.67 0.6 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.495 178.999 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -69.46 -38.16 77.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.896 179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . 0.528 ' N ' ' O ' ' B' ' 444' ' ' GLN . . . -72.64 -71.46 0.29 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.696 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.511 ' C ' ' O ' ' B' ' 447' ' ' ALA . 1.2 pt -15.14 116.02 0.05 OUTLIER Pre-proline 0 N--CA 1.464 0.266 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.397 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -77.7 93.95 1.08 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.907 2.405 . . . . 0.0 112.334 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -51.4 148.56 4.86 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.969 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -48.37 158.39 0.27 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.014 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -148.15 32.35 0.83 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.732 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.213 -0.898 . . . . 0.0 110.911 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.816 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 C2'--O2' 1.433 1.526 0 C5'-C4'-C3' 110.889 -3.074 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.816 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.279 0 O4'-C1'-N19 111.512 3.312 . 0.027 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.597 " O2'" " O5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.673 0 C3'-C2'-C1' 104.933 3.815 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.597 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.321 0 C5'-C4'-C3' 111.131 -2.913 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.559 " O5'" " O2'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.282 0 O4'-C1'-N19 111.221 3.021 . 0.109 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.441 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.576 0 O4'-C1'-N19 110.985 2.785 . 0.06 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.441 ' C6 ' " H2'" ' A' ' 6' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.051 0 O4'-C1'-N19 111.451 3.251 . 0.153 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.639 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.442 2.368 0 O4'-C1'-N19 110.97 2.77 . 0.183 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.639 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.4 0 O4'-C1'-N19 111.083 2.883 . 0.293 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.636 " O2'" " C5'" ' A' ' 11' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.438 2.006 0 O4'-C1'-N19 111.076 2.876 . 0.101 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.636 " C5'" " O2'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.272 0 O4'-C1'-N19 111.077 2.877 . 0.034 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.888 " O5'" ' H6 ' ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.436 1.831 0 O4'-C1'-N19 111.23 3.03 . 0.055 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.785 " O2'" " H5'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.878 0 O4'-C1'-N19 111.161 2.961 . 0.066 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.785 " H5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.636 0 C3'-C2'-C1' 104.083 2.87 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.928 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.311 0 C5'-C4'-C3' 110.966 -3.023 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.928 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -1.981 0 O4'-C1'-N19 111.483 3.283 OUTLIER-DELTA 0.028 1b . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.591 " O2'" " C1'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -2.035 0 C5'-C4'-C3' 110.886 -3.076 . 0.0 OUTLIER alpha 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.652 ' N6 ' ' N3 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.435 1.741 0 O4'-C1'-N19 111.025 2.825 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.892 " O2'" " H5'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.039 0 O4'-C1'-N19 111.238 3.038 . 0.269 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.892 " H5'" " O2'" ' A' ' 19' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.441 0 C3'-C2'-C1' 104.494 3.326 . 0.126 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.55 " O2'" " C5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.43 -1.906 0 C5'-C4'-C3' 110.997 -3.002 . 0.021 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.877 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.436 1.856 0 O4'-C1'-N19 111.144 2.944 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.686 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.261 0 O4'-C1'-N19 111.877 3.677 . 0.065 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.791 ' H6 ' " O5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.236 0 C5'-C4'-C3' 111.448 -2.701 . 0.066 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.512 ' O6 ' ' O4 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.237 0 O4'-C1'-N19 111.316 3.116 . 0.426 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.438 " H2'" ' C6 ' ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.494 0 C5'-C4'-C3' 111.183 -2.878 . 0.087 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.874 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 P--O5' 1.613 2.023 0 C5'-C4'-C3' 111.273 -2.818 . 0.153 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.874 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.472 0 C3'-C2'-C1' 104.903 3.781 . 0.013 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.91 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.24 0 O4'-C1'-N19 111.319 3.119 . 0.08 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 0.91 " H5'" " O2'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.342 0 O4'-C1'-N19 111.39 3.19 . 0.437 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 0.861 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.592 0 O4'-C1'-N19 111.476 3.276 . 0.05 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . 0.424 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.765 0 C3'-C2'-C1' 104.342 3.158 . 0.271 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.215 0 N-CA-C 112.494 -0.243 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 54.3 54.23 9.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.917 0.389 . . . . 0.0 110.948 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . 0.432 ' HB3' ' HB2' ' B' ' 369' ' ' ASN . 0.1 OUTLIER -119.43 118.02 30.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.906 179.918 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.494 ' CA ' HG23 ' B' ' 425' ' ' ILE . 33.9 t0 -61.04 -61.28 2.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.256 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.468 ' HA ' ' CE ' ' B' ' 371' ' ' LYS . 2.1 tmm? -35.51 -53.61 0.67 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.496 179.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . 0.465 ' HA ' ' HE3' ' B' ' 368' ' ' MET . 1.1 m-80 -60.19 -45.49 92.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.28 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.582 ' CB ' ' CB ' ' B' ' 428' ' ' ALA . . . -61.36 -71.7 0.14 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.244 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' B' ' 367' ' ' ASP . 0.1 OUTLIER -34.94 -50.75 0.49 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.901 0.381 . . . . 0.0 110.473 -179.836 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.575 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.3 OUTLIER -55.56 -41.59 73.5 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.881 179.669 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.533 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.3 OUTLIER -66.1 -61.06 2.24 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.141 0.496 . . . . 0.0 110.798 179.601 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.544 ' CD1' ' CB ' ' B' ' 428' ' ' ALA . 0.4 OUTLIER -46.79 -73.24 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.577 0.955 . . . . 0.0 113.577 -178.571 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . 0.468 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.5 m-85 -92.3 -4.93 53.24 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -176.496 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.575 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -113.72 5.28 16.35 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.078 -0.649 . . . . 0.0 110.66 179.122 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.503 HD22 ' OE1' ' B' ' 373' ' ' GLN . 3.7 tp -144.51 -35.85 0.34 Allowed 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.281 179.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.491 ' O ' HD23 ' B' ' 383' ' ' LEU . 5.5 mm -135.36 38.21 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -179.595 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.498 ' HA2' HD21 ' B' ' 383' ' ' LEU . . . -149.81 68.18 0.34 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.591 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.564 ' CG ' ' HD3' ' B' ' 445' ' ' ARG . 15.1 p90 -74.97 -50.9 15.09 Favored 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 121.071 -0.251 . . . . 0.0 110.696 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . 0.538 ' CB ' ' O ' ' B' ' 380' ' ' TYR . . . 158.04 -14.75 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 178.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -124.0 31.69 5.76 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -178.456 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.498 HD21 ' HA2' ' B' ' 379' ' ' GLY . 0.1 OUTLIER -101.0 -8.92 21.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.855 0.359 . . . . 0.0 110.537 178.703 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 57.4 44.05 22.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.145 -0.479 . . . . 0.0 109.95 -179.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.553 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 9.8 tt -90.96 125.84 35.9 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . 0.514 ' O ' ' O ' ' B' ' 405' ' ' ARG . 2.3 p-80 -144.96 148.89 34.31 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 -178.525 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.414 ' CE1' HD21 ' B' ' 385' ' ' LEU . 18.2 m-85 -109.63 148.91 30.49 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.738 -1.119 . . . . 0.0 109.549 177.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . 0.514 HG21 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -125.18 125.44 69.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.149 0.5 . . . . 0.0 110.699 179.44 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 389' ' ' THR . . . . . 0.522 ' O ' ' CG2' ' B' ' 389' ' ' THR . 0.5 OUTLIER -83.84 117.0 23.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.453 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.561 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 33.9 m -130.52 146.74 33.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.156 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.561 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.3 OUTLIER 94.0 19.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.092 -179.812 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.516 ' C ' ' O ' ' B' ' 391' ' ' LYS . 6.4 mttt -6.27 108.32 0.03 OUTLIER Pre-proline 0 N--CA 1.469 0.479 0 O-C-N 123.952 0.782 . . . . 0.0 112.579 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.538 ' HB2' " O2'" ' A' ' 5' ' ' ' U' . 5.5 Cg_exo -47.51 157.14 0.9 Allowed 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 122.661 2.241 . . . . 0.0 113.195 -179.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 394' ' ' THR . . . . . 0.491 ' O ' ' HD3' ' B' ' 398' ' ' PRO . 1.3 p -150.35 164.95 34.51 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.934 -1.03 . . . . 0.0 111.429 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -78.18 5.93 9.18 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.842 0.353 . . . . 0.0 111.297 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . 0.481 ' O ' ' HB2' ' B' ' 397' ' ' ASP . 4.3 m -132.1 12.84 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.454 0.645 . . . . 0.0 109.352 178.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . 0.481 ' HB2' ' O ' ' B' ' 396' ' ' VAL . 32.1 t70 172.56 56.82 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.153 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.511 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 1.5 Cg_endo -44.41 -61.09 0.63 Allowed 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 123.253 2.635 . . . . 0.0 111.856 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.561 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 1.1 p-10 -22.72 137.04 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.899 -1.046 . . . . 0.0 112.221 -179.212 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 45.9 t -140.57 154.78 46.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.945 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.551 HG13 ' N ' ' B' ' 402' ' ' VAL . 0.4 OUTLIER -116.72 142.88 28.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.317 -179.742 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.551 ' N ' HG13 ' B' ' 401' ' ' ILE . 0.2 OUTLIER -107.4 156.35 7.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.666 -179.764 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.514 ' CB ' HG21 ' B' ' 388' ' ' VAL . 0.0 OUTLIER -121.6 110.48 16.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.258 179.114 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.519 ' O ' ' N ' ' B' ' 412' ' ' LEU . 5.7 t -90.5 100.09 12.99 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.855 179.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.514 ' O ' ' O ' ' B' ' 386' ' ' HIS . 6.3 ptm180 -143.25 161.99 36.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.392 0.615 . . . . 0.0 111.889 -178.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.553 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 5.3 m -142.13 151.01 18.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.289 179.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 71.32 3.58 53.67 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.02 -1.086 . . . . 0.0 112.081 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 69.28 21.96 6.85 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.737 0.304 . . . . 0.0 110.78 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -146.25 -46.66 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.424 -0.893 . . . . 0.0 113.182 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.482 ' O ' ' HB2' ' B' ' 405' ' ' ARG . 69.0 m -80.41 125.77 30.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.863 0.364 . . . . 0.0 111.669 -179.365 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 52.9 t -107.88 104.15 16.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.908 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.519 ' N ' ' O ' ' B' ' 404' ' ' CYS . 0.1 OUTLIER -61.47 -26.07 67.65 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.586 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 160.02 -154.14 25.16 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.466 -0.788 . . . . 0.0 112.3 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.501 ' N ' ' OD1' ' B' ' 430' ' ' ASN . 4.6 t -163.25 162.8 25.47 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.108 0.48 . . . . 0.0 111.797 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.521 ' CA ' ' HG2' ' B' ' 426' ' ' ARG . . . -148.04 151.06 23.34 Favored Glycine 0 C--O 1.224 -0.509 0 C-N-CA 120.343 -0.932 . . . . 0.0 113.148 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . 0.442 ' HB ' HD11 ' B' ' 401' ' ' ILE . 5.5 p -142.8 149.6 18.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.728 0.299 . . . . 0.0 110.992 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.561 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -161.3 170.49 37.09 Favored Glycine 0 C--O 1.227 -0.334 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.345 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.555 ' N ' HD13 ' B' ' 422' ' ' ILE . 0.0 OUTLIER -81.95 -44.0 17.33 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 116.903 0.351 . . . . 0.0 111.411 179.951 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.593 ' O ' ' N ' ' B' ' 421' ' ' LYS . 0.2 OUTLIER -99.99 37.08 1.7 Allowed 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 179.52 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.602 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 48.27 -46.47 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 N-CA-C 115.2 1.556 . . . . 0.0 115.2 178.468 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.651 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -43.3 -56.5 3.48 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -179.51 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.651 ' N ' ' HD3' ' B' ' 421' ' ' LYS . 0.0 OUTLIER -47.37 -22.26 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.887 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.602 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -83.17 -46.65 12.48 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 177.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -58.94 -51.5 58.82 Favored Glycine 0 C--N 1.334 0.431 0 N-CA-C 110.271 -1.131 . . . . 0.0 110.271 177.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . 0.548 ' CD1' ' N ' ' B' ' 425' ' ' ILE . 0.9 OUTLIER -61.5 -66.33 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 177.893 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.595 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 7.0 tpt180 -39.02 -32.93 0.1 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.551 179.167 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.484 ' HB2' ' O ' ' B' ' 424' ' ' GLY . . . -62.88 -57.67 10.03 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 178.422 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.582 ' CB ' ' CB ' ' B' ' 370' ' ' ALA . . . -58.24 -53.78 54.44 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.235 178.317 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.499 ' HA ' ' CD2' ' B' ' 432' ' ' LEU . 0.5 OUTLIER -54.47 -17.33 3.03 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.936 179.229 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.501 ' OD1' ' N ' ' B' ' 414' ' ' THR . 1.1 m-80 -81.77 -36.75 28.14 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 178.436 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . . . . . . . . . . . -68.4 -39.43 81.68 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.349 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.55 ' CD2' ' HA ' ' B' ' 370' ' ' ALA . 0.8 OUTLIER -83.24 10.27 8.81 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.85 0.357 . . . . 0.0 111.013 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -86.95 -8.11 57.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.455 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . 0.432 ' O ' ' HG ' ' B' ' 438' ' ' LEU . 1.1 m-20 -117.8 80.52 1.52 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.655 -179.381 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.569 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 1.9 ptpp? -49.68 -54.32 19.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.242 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.569 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -50.35 -39.01 45.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.098 0.475 . . . . 0.0 110.203 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.505 ' CE ' ' HG ' ' B' ' 412' ' ' LEU . 0.8 OUTLIER -76.52 -40.96 48.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.811 178.927 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.499 HD21 ' HA ' ' B' ' 432' ' ' LEU . 83.4 mt -58.36 -64.54 0.89 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.985 179.156 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -49.88 -43.35 49.29 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 178.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.485 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -45.32 -42.49 9.91 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.382 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.493 ' HA ' ' HG2' ' B' ' 444' ' ' GLN . 41.8 m-85 -66.62 -45.78 77.96 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.858 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . 0.487 ' O ' ' N ' ' B' ' 445' ' ' ARG . . . -41.99 -59.74 1.64 Allowed 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.552 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -49.92 -44.59 50.43 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 178.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.493 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -63.12 -12.09 24.86 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.65 179.318 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.564 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -90.41 -36.85 14.35 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.821 -179.746 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -85.74 -37.4 19.39 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.939 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . 0.446 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -59.23 -53.38 58.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.801 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.553 ' CG1' ' O ' ' B' ' 445' ' ' ARG . 1.1 pt -29.77 105.51 0.22 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.814 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_exo -51.62 -167.39 0.0 OUTLIER 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.922 2.414 . . . . 0.0 112.36 179.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . 0.429 ' C ' ' OG ' ' B' ' 451' ' ' SER . 0.6 OUTLIER -177.37 -50.53 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.139 179.86 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 451' ' ' SER . . . . . 0.429 ' OG ' ' C ' ' B' ' 450' ' ' ARG . 0.0 OUTLIER 179.86 -175.78 0.3 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.914 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . 0.418 ' O ' ' C ' ' B' ' 453' ' ' SER . 6.0 mt-10 65.26 76.4 0.33 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.888 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 453' ' ' SER . . . . . 0.418 ' C ' ' O ' ' B' ' 452' ' ' GLU . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.337 -0.84 . . . . 0.0 111.014 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.587 " O2'" " O5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.785 0 C3'-C2'-C1' 104.377 3.197 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.944 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.163 0 O4'-C1'-N19 111.484 3.284 . 0.061 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.944 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.176 0 O4'-C1'-N19 111.315 3.115 . 0.088 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.446 " H2'" ' C6 ' ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.197 0 O4'-C1'-N19 111.473 3.273 . 0.239 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.788 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.022 0 O4'-C1'-N19 111.165 2.965 . 0.023 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.505 " O2'" " H5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.255 0 O4'-C1'-N19 111.161 2.961 . 0.144 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.771 ' H6 ' " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.952 0 O4'-C1'-N19 111.615 3.415 . 0.292 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.676 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.153 0 O4'-C1'-N19 110.952 2.752 . 0.148 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.676 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.231 0 O4'-C1'-N19 111.239 3.039 . 0.068 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.909 ' H6 ' " O5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 P--O5' 1.611 1.837 0 O4'-C1'-N19 111.247 3.047 . 0.064 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.582 " O2'" " O5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.35 0 O4'-C1'-N19 111.165 2.965 . 0.028 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.814 " O5'" ' H6 ' ' A' ' 12' ' ' ' U' . . . . . . . . 0 P--O5' 1.611 1.823 0 O4'-C1'-N19 111.14 2.94 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.806 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.641 0 C3'-C2'-C1' 104.692 3.547 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.651 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.454 0 O4'-C1'-N19 111.35 3.15 . 0.037 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.805 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.428 -2.045 0 C5'-C4'-C3' 110.849 -3.101 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.805 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.432 -1.745 0 O4'-C1'-N19 111.775 3.575 . 0.0 OUTLIER alpha 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.711 ' N7 ' H5'' ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.429 -1.986 0 C5'-C4'-C3' 110.776 -3.149 OUTLIER-EPSILON 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.709 ' P ' " O2'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.716 0 C5'-C4'-C3' 110.967 -3.022 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.616 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.269 0 O4'-C1'-N19 111.298 3.098 . 0.012 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.752 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.436 1.836 0 C5'-C4'-C3' 111.217 -2.855 . 0.149 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.752 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.389 0 C5'-C4'-C3' 110.851 -3.099 . 0.31 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.861 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.003 0 O4'-C1'-N19 111.098 2.898 . 0.09 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.829 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.228 0 O4'-C1'-N19 111.812 3.612 . 0.034 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.789 ' H6 ' " O5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.042 0 O4'-C1'-N19 110.88 2.68 . 0.082 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.441 2.242 0 O4'-C1'-N19 111.238 3.038 . 0.444 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.482 " O2'" " H5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.44 0 O4'-C1'-N19 111.129 2.929 . 0.166 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.917 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.179 0 O4'-C1'-N19 111.169 2.969 . 0.302 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.917 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.414 0 C3'-C2'-C1' 104.333 3.148 . 0.121 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.73 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.125 0 C5'-C4'-C3' 111.258 -2.828 . 0.171 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 1.051 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.159 0 O4'-C1'-N19 111.572 3.372 . 0.378 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 1.051 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.527 0 O4'-C1'-N19 111.232 3.032 . 0.245 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.39 0 O4'-C1'-N19 111.139 2.939 . 0.43 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.139 0 N-CA-C 112.55 -0.22 . . . . 0.0 112.55 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 14.8 m 59.97 59.68 2.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.903 0.382 . . . . 0.0 110.746 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -138.32 132.93 32.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.017 -179.801 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.53 ' HB3' ' CG1' ' B' ' 425' ' ' ILE . 0.3 OUTLIER -54.67 -68.48 0.18 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 179.44 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.521 ' N ' ' HE2' ' B' ' 371' ' ' LYS . 12.5 tmm? -34.84 -45.59 0.26 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.491 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -62.57 -44.41 96.39 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.872 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.556 ' O ' ' N ' ' B' ' 373' ' ' GLN . . . -60.36 -69.68 0.21 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 179.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.521 ' HE2' ' N ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -34.13 -51.02 0.42 Allowed 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.509 179.894 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.559 ' O ' ' CB ' ' B' ' 376' ' ' SER . 2.3 tmm_? -56.96 -40.05 75.76 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.783 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.556 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -62.28 -59.03 5.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.121 0.486 . . . . 0.0 110.322 178.846 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.541 ' CD2' HD23 ' B' ' 432' ' ' LEU . 1.7 mt -47.56 -72.65 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.3 -0.864 . . . . 0.0 113.162 -178.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . 0.451 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 24.9 m-85 -74.18 -48.45 29.04 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 -176.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.559 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -63.25 -54.6 34.7 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.652 -178.576 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.46 ' O ' HD11 ' B' ' 378' ' ' ILE . 0.2 OUTLIER -71.78 -43.85 65.0 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -178.331 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.468 HD13 ' O ' ' B' ' 438' ' ' LEU . 8.7 mm -114.59 -58.98 3.34 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -177.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.451 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -63.56 66.44 0.04 OUTLIER Glycine 0 CA--C 1.516 0.131 0 C-N-CA 121.14 -0.553 . . . . 0.0 113.117 -179.123 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.599 ' CD1' ' HG2' ' B' ' 445' ' ' ARG . 10.4 p90 -49.01 -35.45 15.43 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 111.567 0.21 . . . . 0.0 111.567 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . 0.568 ' CB ' ' O ' ' B' ' 380' ' ' TYR . . . 151.48 -10.31 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.586 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 382' ' ' SER . . . . . 0.487 ' O ' ' OH ' ' B' ' 380' ' ' TYR . 0.3 OUTLIER -147.43 50.85 1.07 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.916 0.389 . . . . 0.0 110.426 179.715 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.462 ' CD1' HG23 ' B' ' 378' ' ' ILE . 0.8 OUTLIER -106.13 -15.67 14.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.793 -179.961 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . 0.502 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 0.2 OUTLIER 65.89 60.6 0.67 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.111 179.808 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.566 ' HG ' ' CG1' ' B' ' 406' ' ' VAL . 2.6 tt -105.67 124.62 49.85 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . 0.544 ' O ' ' O ' ' B' ' 405' ' ' ARG . 15.2 p-80 -144.0 148.27 35.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.612 0.72 . . . . 0.0 112.746 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.516 ' CE2' ' HB1' ' B' ' 427' ' ' ALA . 35.3 m-85 -107.23 144.69 33.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.388 -0.823 . . . . 0.0 111.266 179.077 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . 0.476 HG23 ' HB3' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -125.83 125.92 69.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.762 179.332 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.1 m -88.01 122.43 31.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.209 -179.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.537 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 18.2 m -125.1 157.64 33.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.192 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.537 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.2 OUTLIER 89.56 24.07 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.197 179.954 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.52 ' C ' ' O ' ' B' ' 391' ' ' LYS . 8.2 mmpt? 5.44 108.51 0.01 OUTLIER Pre-proline 0 N--CA 1.471 0.605 0 O-C-N 123.938 0.774 . . . . 0.0 112.317 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.454 ' HD2' ' HA ' ' B' ' 392' ' ' LYS . 3.3 Cg_endo -51.31 162.57 1.29 Allowed 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.709 2.273 . . . . 0.0 113.891 -179.119 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 2.5 p -126.58 160.2 31.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.573 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -91.78 20.35 5.68 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-O 121.316 0.579 . . . . 0.0 110.573 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . 0.573 ' CG1' HO2' ' A' ' 30' ' ' ' C' . 23.1 m -138.32 13.52 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.323 177.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . 0.47 ' O ' ' N ' ' B' ' 399' ' ' ASN . 0.7 OUTLIER 159.23 64.28 0.0 OUTLIER Pre-proline 0 N--CA 1.451 -0.392 0 CA-C-N 114.659 -1.155 . . . . 0.0 108.79 -179.238 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.518 ' O ' ' C ' ' B' ' 399' ' ' ASN . 83.4 Cg_exo -37.34 -23.2 0.05 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.322 0 C-N-CA 123.63 2.886 . . . . 0.0 113.676 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.518 ' C ' ' O ' ' B' ' 398' ' ' PRO . 21.1 m120 -20.57 109.4 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.271 0 O-C-N 123.537 0.523 . . . . 0.0 111.537 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 38.1 t -131.78 146.3 52.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.256 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.562 HD11 ' N ' ' B' ' 402' ' ' VAL . 0.0 OUTLIER -108.29 151.76 10.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.37 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.562 ' N ' HD11 ' B' ' 401' ' ' ILE . 0.2 OUTLIER -119.45 157.93 21.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.781 -178.692 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.476 ' HB3' HG23 ' B' ' 388' ' ' VAL . 0.7 OUTLIER -121.34 118.31 29.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.741 178.895 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.546 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -93.09 98.53 11.38 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.222 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.544 ' O ' ' O ' ' B' ' 386' ' ' HIS . 1.0 OUTLIER -133.69 158.2 43.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.348 0.594 . . . . 0.0 112.033 -178.291 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.566 ' CG1' ' HG ' ' B' ' 385' ' ' LEU . 2.6 m -138.88 178.65 3.77 Favored 'Isoleucine or valine' 0 C--O 1.238 0.463 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.234 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . 0.436 ' O ' ' HG2' ' B' ' 384' ' ' ARG . . . 64.77 -92.55 0.13 Allowed Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.898 -0.667 . . . . 0.0 112.375 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -163.64 25.94 0.08 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.902 0.382 . . . . 0.0 110.588 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . 0.48 ' HA2' ' NE ' ' B' ' 405' ' ' ARG . . . 163.66 -12.56 0.09 OUTLIER Glycine 0 CA--C 1.522 0.477 0 C-N-CA 120.445 -0.883 . . . . 0.0 113.643 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.542 ' O ' ' CB ' ' B' ' 405' ' ' ARG . 42.4 m -71.8 134.24 46.03 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 117.531 0.665 . . . . 0.0 110.646 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . 0.435 ' HA ' ' HA ' ' B' ' 405' ' ' ARG . 80.3 t -119.18 114.11 43.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.742 0.306 . . . . 0.0 111.733 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.546 ' N ' ' O ' ' B' ' 404' ' ' CYS . 0.2 OUTLIER -75.29 -32.45 61.0 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.145 179.024 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . 0.457 ' O ' ' SG ' ' B' ' 404' ' ' CYS . . . 174.4 -168.74 41.58 Favored Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.003 -1.094 . . . . 0.0 113.319 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.454 ' N ' ' OD1' ' B' ' 430' ' ' ASN . 0.1 OUTLIER -146.42 158.46 43.89 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.572 -0.314 . . . . 0.0 111.612 -179.161 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.586 ' CA ' ' CG ' ' B' ' 426' ' ' ARG . . . -152.06 138.11 6.3 Favored Glycine 0 C--O 1.225 -0.418 0 C-N-CA 120.451 -0.881 . . . . 0.0 112.833 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . 0.482 HG21 ' N ' ' B' ' 417' ' ' GLY . 12.9 p -119.63 150.3 22.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 179.402 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.489 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -159.73 148.6 17.42 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.267 -0.968 . . . . 0.0 112.262 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.502 ' N ' HD12 ' B' ' 422' ' ' ILE . 4.3 ptt85 -67.51 -42.47 82.78 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.788 0.327 . . . . 0.0 111.434 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.532 ' O ' HG13 ' B' ' 420' ' ' ILE . 0.1 OUTLIER -100.3 26.74 6.26 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.959 179.358 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.598 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 55.14 -46.21 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 179.597 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.516 ' O ' ' N ' ' B' ' 424' ' ' GLY . 0.0 OUTLIER -44.53 -58.51 2.95 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 119.913 -0.715 . . . . 0.0 109.239 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.612 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.1 OUTLIER -46.0 -27.92 0.75 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.426 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 177.563 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.598 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -70.97 -51.09 27.71 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 176.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -61.11 -44.2 98.46 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.23 -0.986 . . . . 0.0 111.474 178.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . 0.53 ' CG1' ' HB3' ' B' ' 367' ' ' ASP . 1.4 mp -81.63 -3.45 6.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 120.715 0.293 . . . . 0.0 111.391 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.612 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -96.71 -29.67 13.66 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 176.839 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.516 ' HB1' ' CE2' ' B' ' 387' ' ' TYR . . . -69.95 -42.58 73.04 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.531 -1.285 . . . . 0.0 107.531 176.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.51 ' O ' ' CD2' ' B' ' 432' ' ' LEU . . . -63.13 -56.93 12.6 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.406 ' HB2' ' O ' ' B' ' 425' ' ' ILE . 0.0 OUTLIER -51.41 -22.06 2.73 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.574 178.231 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.454 ' OD1' ' N ' ' B' ' 414' ' ' THR . 0.9 OUTLIER -79.47 -39.25 32.65 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.955 179.166 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.455 ' O ' HD22 ' B' ' 438' ' ' LEU . . . -67.25 -30.42 70.32 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.146 -179.281 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.542 ' CB ' ' HG3' ' B' ' 373' ' ' GLN . 0.2 OUTLIER -95.47 8.24 43.85 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.877 179.772 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.73 -17.23 36.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.077 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . 0.539 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 0.7 OUTLIER -102.85 82.94 2.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.163 -179.12 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.569 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 12.0 ptmt -52.15 -54.69 27.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.924 0.392 . . . . 0.0 110.053 179.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.569 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 1.5 mmpt? -51.73 -42.67 62.48 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.59 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.539 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 0.2 OUTLIER -71.78 -48.99 42.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.004 0.43 . . . . 0.0 110.145 179.188 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.538 ' CD1' ' HA ' ' B' ' 432' ' ' LEU . 83.1 mt -52.97 -60.9 2.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.433 0.635 . . . . 0.0 110.019 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . 0.519 ' O ' ' N ' ' B' ' 442' ' ' ALA . 29.1 t70 -56.01 -44.35 78.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.264 -0.88 . . . . 0.0 108.897 178.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.478 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.6 OUTLIER -43.38 -45.01 5.96 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 179.343 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.477 ' O ' ' HB2' ' B' ' 444' ' ' GLN . 45.5 m-85 -64.85 -39.42 93.53 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.936 178.368 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . 0.519 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -45.34 -62.54 1.22 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.069 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -45.87 -48.92 15.89 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 178.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.477 ' HB2' ' O ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -50.2 -54.58 19.94 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.037 178.148 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.599 ' HG2' ' CD1' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -41.71 -42.77 2.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.13 179.048 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -72.42 -38.0 68.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.286 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . 0.491 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -66.85 -64.05 0.93 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.022 -179.205 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.555 ' CG1' ' O ' ' B' ' 445' ' ' ARG . 0.9 OUTLIER -20.87 95.92 0.05 OUTLIER Pre-proline 0 C--N 1.333 -0.149 0 O-C-N 123.766 0.667 . . . . 0.0 112.115 -179.936 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_exo -40.68 -56.74 1.5 Allowed 'Trans proline' 0 N--CA 1.462 -0.337 0 C-N-CA 122.888 2.392 . . . . 0.0 112.593 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.77 141.19 20.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.85 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 12.9 p -69.77 106.11 3.0 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.772 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -57.28 -29.38 63.81 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.802 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 4.3 t . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.213 -0.899 . . . . 0.0 110.932 179.903 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.823 " O5'" ' H8 ' ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.433 1.558 0 O4'-C1'-N19 111.185 2.985 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.606 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.246 0 O4'-C1'-N19 111.361 3.161 . 0.215 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.629 " O2'" " C5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.569 0 C5'-C4'-C3' 111.377 -2.749 . 0.13 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.629 " C5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.238 0 C5'-C4'-C3' 111.223 -2.851 . 0.122 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.556 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.114 0 O4'-C1'-N19 111.238 3.038 . 0.13 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.638 HO2' " C5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.401 0 O4'-C1'-N19 111.203 3.003 . 0.058 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.688 ' H6 ' " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.054 0 O4'-C1'-N19 111.482 3.282 . 0.131 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.504 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.442 2.327 0 O4'-C1'-N19 111.055 2.855 . 0.262 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.504 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.322 0 O4'-C1'-N19 111.091 2.891 . 0.094 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.787 ' H6 ' " O5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 1.959 0 C5'-C4'-C3' 110.935 -3.043 . 0.3 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.651 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.195 0 O4'-C1'-N19 111.127 2.927 . 0.053 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.764 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.437 1.917 0 O4'-C1'-N19 111.311 3.111 . 0.025 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.764 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.428 -2.049 0 O4'-C1'-N19 111.335 3.135 . 0.027 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.654 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.139 0 C5'-C4'-C3' 111.163 -2.891 . 0.057 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.631 " O2'" ' N1 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.431 -1.797 0 C5'-C4'-C3' 110.882 -3.079 . 0.225 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.657 " H4'" ' OP2' ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.431 -1.863 0 C5'-C4'-C3' 110.743 -3.171 OUTLIER-EPSILON 0.051 1b . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.821 " H1'" ' OP1' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.363 0 C5'-C4'-C3' 110.686 -3.209 OUTLIER-EPSILON 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.821 ' OP1' " H1'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 P--O5' 1.612 1.865 0 O4'-C1'-N19 111.336 3.136 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.654 ' C4 ' ' NH2' ' B' ' 372' ' ' ARG . . . . . . . . 0 O4'--C1' 1.439 2.119 0 O4'-C1'-N19 111.26 3.06 . 0.077 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.812 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.434 1.672 0 C5'-C4'-C3' 110.979 -3.014 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.756 " O4'" " H2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.441 0 C5'-C4'-C3' 110.796 -3.136 . 0.033 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.867 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.921 0 C5'-C4'-C3' 111.142 -2.905 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.825 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.309 0 O4'-C1'-N19 111.564 3.364 . 0.043 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.783 ' H6 ' " O5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 P--O5' 1.615 2.163 0 C5'-C4'-C3' 111.332 -2.779 . 0.074 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.443 2.408 0 O4'-C1'-N19 111.372 3.172 . 0.356 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.326 0 O4'-C1'-N19 111.351 3.151 . 0.111 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.714 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.101 0 O4'-C1'-N19 111.149 2.949 . 0.175 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.714 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.283 0 C5'-C4'-C3' 111.002 -2.999 . 0.078 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.758 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.243 0 O4'-C1'-N19 111.179 2.979 . 0.136 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 0.962 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.356 0 O4'-C1'-N19 111.453 3.253 . 0.077 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 0.962 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.661 0 C3'-C2'-C1' 104.243 3.047 . 0.149 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . 0.584 " H5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.528 0 O4'-C1'-N19 111.225 3.025 . 0.448 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.24 0 N-CA-C 112.363 -0.295 . . . . 0.0 112.363 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 365' ' ' SER . . . . . 0.467 ' O ' ' SD ' ' B' ' 368' ' ' MET . 0.8 OUTLIER -136.9 57.57 1.76 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.805 0.336 . . . . 0.0 110.826 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . 0.483 ' O ' ' HB2' ' B' ' 369' ' ' ASN . 7.5 mt -45.0 -24.24 0.21 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.352 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.514 ' HA ' ' CG2' ' B' ' 425' ' ' ILE . 0.0 OUTLIER -45.75 -71.92 0.07 Allowed 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 178.844 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.603 ' CE ' ' ND2' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -34.37 -44.61 0.2 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.558 179.311 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . 0.603 ' ND2' ' CE ' ' B' ' 368' ' ' MET . 4.5 m-20 -56.33 -52.18 65.51 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.916 0.388 . . . . 0.0 110.529 179.25 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.527 ' CB ' ' HB1' ' B' ' 428' ' ' ALA . . . -61.22 -70.7 0.17 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.67 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.448 ' HG2' " O2'" ' A' ' 20' ' ' ' A' . 0.3 OUTLIER -36.6 -38.82 0.18 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.134 0.493 . . . . 0.0 110.428 179.924 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.655 ' CZ ' ' C2 ' ' A' ' 18' ' ' ' A' . 0.0 OUTLIER -65.34 -42.32 92.98 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.883 179.799 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.552 ' HG3' ' CB ' ' B' ' 432' ' ' LEU . 0.1 OUTLIER -59.14 -44.75 92.07 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.583 0.706 . . . . 0.0 110.264 179.136 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.434 HD11 HD22 ' B' ' 385' ' ' LEU . 2.3 mm? -58.68 -69.77 0.18 Allowed 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 -178.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . 0.459 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 5.2 m-30 -96.67 12.03 33.28 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -176.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.572 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.7 OUTLIER -129.81 -1.3 4.78 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.571 179.268 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.536 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 8.8 mp -140.25 -27.52 0.75 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.279 178.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.468 ' O ' HD12 ' B' ' 383' ' ' LEU . 4.5 mm -144.38 39.25 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.169 0 CA-C-O 120.644 0.259 . . . . 0.0 111.536 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.459 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -121.72 97.41 0.61 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.895 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.574 ' CE1' ' HB2' ' B' ' 383' ' ' LEU . 46.4 p90 -124.11 -172.98 2.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.639 0.257 . . . . 0.0 110.634 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . 0.505 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -96.36 83.17 3.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.42 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 382' ' ' SER . . . . . 0.505 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 3.2 t 157.7 -34.8 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.103 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.574 ' HB2' ' CE1' ' B' ' 380' ' ' TYR . 1.2 tt -45.84 -42.18 12.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.744 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . 0.483 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 0.9 OUTLIER 62.55 59.58 1.47 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.761 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.557 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 7.0 tt -101.32 132.64 46.76 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.869 -179.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . 0.459 ' O ' ' O ' ' B' ' 405' ' ' ARG . 24.9 p-80 -149.78 151.9 34.32 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.3 0.572 . . . . 0.0 112.419 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.58 ' CE2' ' HB3' ' B' ' 404' ' ' CYS . 7.1 m-85 -107.26 150.01 27.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.009 178.402 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . 0.449 HG22 ' HB3' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -132.42 129.88 59.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.0 179.463 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.3 m -92.31 124.29 36.26 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.661 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.498 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 24.2 m -128.3 158.01 40.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.161 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.523 ' O ' ' C ' ' B' ' 392' ' ' LYS . 4.0 tptp 85.82 23.34 0.08 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.67 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.523 ' C ' ' O ' ' B' ' 391' ' ' LYS . 64.2 mmtt -1.29 119.63 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.693 0 O-C-N 124.104 0.877 . . . . 0.0 112.475 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.509 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 17.8 Cg_exo -63.1 159.9 36.72 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.565 2.177 . . . . 0.0 113.077 -179.482 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 394' ' ' THR . . . . . 0.459 ' O ' ' HD3' ' B' ' 398' ' ' PRO . 3.1 p -151.79 167.84 26.96 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.621 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -84.67 10.83 10.2 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.161 0.505 . . . . 0.0 110.73 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . 0.452 HG21 ' OG1' ' B' ' 394' ' ' THR . 13.8 m -130.42 17.37 2.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 108.841 -0.799 . . . . 0.0 108.841 178.148 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . 0.449 ' CB ' ' O ' ' B' ' 396' ' ' VAL . 0.5 OUTLIER 159.47 58.73 0.0 OUTLIER Pre-proline 0 N--CA 1.451 -0.387 0 CA-C-N 114.578 -1.192 . . . . 0.0 109.184 -179.322 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.509 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 0.9 OUTLIER -42.93 -52.02 5.01 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 123.65 2.9 . . . . 0.0 112.285 -179.769 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.529 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 1.0 OUTLIER -24.54 134.08 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.827 -179.431 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 38.9 t -138.81 151.05 46.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.984 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.566 HG13 ' N ' ' B' ' 402' ' ' VAL . 0.3 OUTLIER -109.72 142.94 20.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.037 -179.946 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.566 ' N ' HG13 ' B' ' 401' ' ' ILE . 1.6 t -108.26 160.83 7.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.6 -179.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.449 ' HB3' HG22 ' B' ' 388' ' ' VAL . 2.4 mt-10 -131.37 116.28 17.35 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.725 179.166 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.58 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -102.11 107.05 18.01 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.358 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.531 ' HA ' ' O ' ' B' ' 410' ' ' THR . 22.9 ptt180 -144.2 165.21 28.5 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.671 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.557 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 1.3 m -147.47 160.34 8.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.102 -179.036 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 65.84 2.71 13.09 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.905 -0.664 . . . . 0.0 113.414 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 7.3 t0 72.32 13.79 5.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.928 0.364 . . . . 0.0 111.16 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -157.43 14.63 0.3 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.243 -0.98 . . . . 0.0 113.488 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.531 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 2.5 m -133.83 121.4 21.74 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 117.057 0.429 . . . . 0.0 111.478 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 19.1 t -106.47 102.83 14.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.61 0.243 . . . . 0.0 110.41 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.54 ' N ' ' CD1' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -61.24 -25.33 67.0 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.838 -0.431 . . . . 0.0 109.838 179.422 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . 0.418 ' C ' ' SG ' ' B' ' 404' ' ' CYS . . . 164.61 -163.7 36.39 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.401 -0.904 . . . . 0.0 112.56 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.485 ' OG1' ' O ' ' B' ' 402' ' ' VAL . 3.5 t -160.34 159.75 31.58 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.982 0.42 . . . . 0.0 111.4 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.527 ' CA ' ' HD2' ' B' ' 426' ' ' ARG . . . -152.01 165.0 30.61 Favored Glycine 0 C--O 1.225 -0.443 0 C-N-CA 120.173 -1.013 . . . . 0.0 114.111 -179.144 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . 0.472 ' CG2' ' HB ' ' B' ' 401' ' ' ILE . 0.8 OUTLIER -152.76 144.91 15.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.396 -0.402 . . . . 0.0 111.412 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.529 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -155.98 177.16 33.2 Favored Glycine 0 C--N 1.329 0.187 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.133 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.527 ' N ' HD12 ' B' ' 422' ' ' ILE . 9.2 ptm180 -88.23 -43.26 11.72 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.848 0.324 . . . . 0.0 111.72 -179.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.586 ' O ' ' N ' ' B' ' 421' ' ' LYS . 0.2 OUTLIER -99.25 34.18 2.23 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 179.719 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.615 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 48.85 -45.04 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 178.509 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.635 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.7 OUTLIER -42.72 -56.04 3.34 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 -179.817 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.635 ' N ' ' HD3' ' B' ' 421' ' ' LYS . 0.1 OUTLIER -47.66 -24.94 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 CA-C-O 121.476 0.655 . . . . 0.0 109.513 178.32 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.615 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -76.48 -49.57 16.22 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.838 -1.074 . . . . 0.0 108.108 176.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . 0.492 ' O ' ' HB2' ' B' ' 427' ' ' ALA . . . -63.92 -52.57 44.02 Favored Glycine 0 N--CA 1.448 -0.519 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.247 179.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . 0.533 HG12 ' HG2' ' B' ' 421' ' ' LYS . 1.5 mm -64.65 -69.27 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.742 0.306 . . . . 0.0 110.531 179.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.542 ' HB3' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -47.37 -25.53 1.04 Allowed 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.278 -178.9 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.519 ' HB3' ' HB ' ' B' ' 402' ' ' VAL . . . -60.7 -59.09 5.93 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 107.675 -1.232 . . . . 0.0 107.675 176.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.53 ' O ' ' CD1' ' B' ' 432' ' ' LEU . . . -52.92 -48.73 67.03 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 177.23 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.512 ' HA ' HD22 ' B' ' 432' ' ' LEU . 1.9 tt0 -52.94 -17.84 1.64 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.732 178.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.474 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 10.4 m120 -85.25 -35.78 21.35 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.047 178.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.484 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -67.32 -36.31 81.2 Favored 'General case' 0 N--CA 1.461 0.116 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.733 -179.271 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.552 ' CB ' ' HG3' ' B' ' 373' ' ' GLN . 0.0 OUTLIER -94.01 12.2 27.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.805 179.58 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -87.04 -12.61 46.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.25 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -112.47 93.55 4.49 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.881 0.372 . . . . 0.0 111.4 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.556 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 8.9 ptmm? -57.37 -50.78 71.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.38 179.516 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.556 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -51.73 -45.39 63.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.637 179.896 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.491 ' O ' ' HB3' ' B' ' 440' ' ' PHE . 1.2 ttp -72.81 -46.69 51.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.113 0.482 . . . . 0.0 110.238 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.527 ' CD1' ' HA ' ' B' ' 432' ' ' LEU . 62.1 mt -53.98 -60.44 3.33 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.672 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . 0.415 ' O ' ' N ' ' B' ' 442' ' ' ALA . 22.4 t70 -54.43 -44.3 72.32 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.515 179.19 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.491 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -43.49 -45.07 6.29 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.609 -0.885 . . . . 0.0 108.609 179.424 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.423 ' O ' ' C ' ' B' ' 442' ' ' ALA . 51.7 m-85 -64.65 -43.17 94.5 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.331 179.039 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . 0.507 ' O ' ' N ' ' B' ' 445' ' ' ARG . . . -42.32 -61.79 1.11 Allowed 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 178.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -48.86 -45.7 41.26 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.418 ' O ' HG21 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -65.19 -7.72 14.07 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.942 178.898 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.546 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -89.54 -44.18 10.29 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.374 179.441 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -82.37 -33.03 28.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.571 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . 0.428 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -60.71 -57.89 10.78 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.921 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.525 ' CG1' ' O ' ' B' ' 445' ' ' ARG . 12.7 pt -35.04 107.87 0.33 Allowed Pre-proline 0 N--CA 1.45 -0.454 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.899 179.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -82.84 126.08 4.4 Favored 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 123.046 2.498 . . . . 0.0 112.551 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.51 47.57 1.19 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.058 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 42.37 65.19 0.95 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.073 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -77.74 -65.41 0.97 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.671 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 453' ' ' SER . . . . . 0.455 ' OXT' ' OG ' ' B' ' 453' ' ' SER . 11.9 t . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.831 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.586 " O2'" " O5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.573 0 O4'-C1'-N19 111.388 3.188 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.72 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.136 0 O4'-C1'-N19 111.14 2.94 . 0.113 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.72 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.166 0 O4'-C1'-N19 111.077 2.877 . 0.448 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.62 " O2'" " C5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.247 0 C5'-C4'-C3' 111.325 -2.784 . 0.122 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.62 " C5'" " O2'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.041 0 O4'-C1'-N19 111.232 3.032 . 0.19 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.538 " O2'" " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.445 0 C3'-C2'-C1' 104.144 2.938 . 0.073 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.566 ' H6 ' " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.099 0 O4'-C1'-N19 111.429 3.229 . 0.138 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.63 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.236 0 C5'-C4'-C3' 111.57 -2.62 . 0.154 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.638 " O2'" " C5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.449 0 C5'-C4'-C3' 111.175 -2.884 . 0.124 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.638 " C5'" " O2'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -1.968 0 O4'-C1'-N19 111.185 2.985 . 0.021 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.621 " C5'" " O2'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.526 0 C5'-C4'-C3' 111.233 -2.845 . 0.044 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.764 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.034 0 O4'-C1'-N19 111.437 3.237 . 0.023 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.835 " O2'" " H5'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.149 0 O4'-C1'-N19 111.318 3.118 . 0.046 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.835 " H5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.545 0 C5'-C4'-C3' 111.203 -2.864 . 0.022 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.881 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.485 0 C5'-C4'-C3' 110.923 -3.051 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.881 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.433 -1.653 0 O4'-C1'-N19 111.62 3.42 . 0.241 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.898 " O5'" ' H8 ' ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.052 0 C3'-C2'-C1' 104.66 3.511 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.771 ' OP1' " H4'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.836 0 C5'-C4'-C3' 111.394 -2.737 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.623 " O2'" " H5'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 1.992 0 O4'-C1'-N19 111.306 3.106 . 0.022 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.623 " H5'" " O2'" ' A' ' 19' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.554 0 C3'-C2'-C1' 104.887 3.763 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.587 " O2'" " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.258 0 C5'-C4'-C3' 111.056 -2.963 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.866 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.612 1.933 0 O4'-C1'-N19 111.0 2.8 . 0.037 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.814 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.445 0 O4'-C1'-N19 111.63 3.43 . 0.016 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.67 ' H6 ' " O5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.265 0 C5'-C4'-C3' 111.367 -2.755 . 0.071 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.407 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.438 2.035 0 O4'-C1'-N19 111.334 3.134 . 0.432 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.446 " H2'" ' C6 ' ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.349 0 O4'-C1'-N19 111.2 3.0 . 0.083 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.583 ' H6 ' " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.105 0 O4'-C1'-N19 110.996 2.796 . 0.21 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.591 " O2'" " O5'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.144 0 O4'-C1'-N19 111.219 3.019 . 0.127 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.591 " O5'" " O2'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.443 2.408 0 O4'-C1'-N19 110.984 2.784 . 0.143 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 0.594 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.25 0 O4'-C1'-N19 111.31 3.11 . 0.212 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 0.599 " O2'" " O4'" ' A' ' 32' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.543 0 O4'-C1'-N19 111.489 3.289 . 0.191 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . 0.599 " O4'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.576 0 C5'-C4'-C3' 111.323 -2.784 . 0.14 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.226 0 N-CA-C 112.603 -0.199 . . . . 0.0 112.603 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 365' ' ' SER . . . . . 0.515 ' O ' ' CG2' ' B' ' 425' ' ' ILE . 4.6 t 54.13 24.86 5.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.951 0.405 . . . . 0.0 110.891 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . 0.434 HD21 ' ND2' ' B' ' 369' ' ' ASN . 14.9 tp -37.12 126.07 0.96 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.219 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.466 ' O ' ' N ' ' B' ' 370' ' ' ALA . 21.5 t0 -58.29 -64.92 0.75 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.179 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.491 ' HA ' ' CE ' ' B' ' 371' ' ' LYS . 1.5 ttp -35.82 -44.05 0.33 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.615 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . 0.434 ' ND2' HD21 ' B' ' 366' ' ' LEU . 2.7 m-80 -60.99 -47.91 84.28 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.571 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.601 ' CB ' ' CB ' ' B' ' 428' ' ' ALA . . . -58.94 -70.59 0.14 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.626 179.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.491 ' CE ' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -36.22 -49.48 0.68 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.814 179.924 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.557 ' O ' ' CB ' ' B' ' 376' ' ' SER . 1.6 tmm_? -55.42 -38.44 68.98 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.508 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.541 ' HG3' ' CB ' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -65.58 -62.61 1.42 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.598 0.713 . . . . 0.0 110.425 179.175 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.477 HD11 ' OH ' ' B' ' 387' ' ' TYR . 1.0 OUTLIER -43.2 -70.77 0.1 Allowed 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -178.959 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -93.04 -20.83 20.16 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 -176.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.557 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.6 OUTLIER -94.45 1.6 55.76 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 119.91 -0.716 . . . . 0.0 111.1 -179.525 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.531 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 0.3 OUTLIER -134.68 -37.83 0.83 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.663 178.218 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.464 ' O ' ' C ' ' B' ' 379' ' ' GLY . 0.8 OUTLIER -127.76 -149.33 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.898 179.284 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.464 ' C ' ' O ' ' B' ' 378' ' ' ILE . . . 28.74 74.24 0.03 OUTLIER Glycine 0 C--N 1.332 0.338 0 C-N-CA 121.35 -0.452 . . . . 0.0 113.506 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.597 ' CD1' ' HD2' ' B' ' 445' ' ' ARG . 13.7 p90 -100.12 -50.76 3.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.697 0.248 . . . . 0.0 111.176 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . 0.516 ' CB ' ' O ' ' B' ' 380' ' ' TYR . . . 158.98 66.03 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.957 0.408 . . . . 0.0 111.079 179.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 382' ' ' SER . . . . . 0.548 ' HB2' ' CZ ' ' B' ' 380' ' ' TYR . 7.0 t -171.91 -72.18 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.795 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -49.22 -26.41 2.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.248 179.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . 0.462 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 7.1 tpt180 68.56 70.87 0.29 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.101 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.545 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 10.5 tt -89.18 121.98 32.02 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 179.118 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . 0.514 ' O ' ' O ' ' B' ' 405' ' ' ARG . 2.5 p-80 -141.57 145.87 35.61 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.401 0.62 . . . . 0.0 112.584 -179.025 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.477 ' OH ' HD11 ' B' ' 374' ' ' LEU . 28.7 m-85 -99.43 151.85 20.64 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.363 178.156 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . 0.546 HG21 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -129.82 120.35 49.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.345 179.114 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.9 m -87.06 119.11 26.93 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.257 -179.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.483 HG21 ' CG2' ' B' ' 401' ' ' ILE . 34.0 m -126.75 151.94 34.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.132 179.382 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.482 ' HB2' ' CG2' ' B' ' 401' ' ' ILE . 0.0 OUTLIER 73.81 111.72 0.07 Allowed 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -178.834 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.404 ' HA ' ' HD3' ' B' ' 393' ' ' PRO . 21.1 mttt -96.54 133.13 25.09 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 120.93 0.395 . . . . 0.0 111.281 -179.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.51 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 24.3 Cg_exo -62.22 166.04 13.64 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.631 2.22 . . . . 0.0 112.393 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 394' ' ' THR . . . . . 0.463 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 64.4 p -150.64 173.88 13.63 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.459 179.178 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . 0.436 ' C ' HG11 ' B' ' 396' ' ' VAL . . . -85.92 15.02 5.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.192 0.52 . . . . 0.0 110.58 179.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . 0.436 HG11 ' C ' ' B' ' 395' ' ' ALA . 22.8 m -146.79 16.73 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.272 178.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 167.86 68.29 0.01 OUTLIER Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.111 -179.391 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.524 ' HB2' ' O ' ' B' ' 418' ' ' ARG . 14.2 Cg_endo -55.4 -42.86 64.04 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 123.237 2.625 . . . . 0.0 112.311 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.54 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 6.0 m-20 -20.07 124.17 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.671 -179.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -133.79 141.57 47.53 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.361 178.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.516 HG13 ' N ' ' B' ' 402' ' ' VAL . 0.2 OUTLIER -114.05 138.46 43.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-O 121.269 0.557 . . . . 0.0 111.376 -179.058 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.526 ' CG2' ' O ' ' B' ' 423' ' ' ALA . 0.7 OUTLIER -105.11 166.7 3.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.433 -179.879 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.546 ' CB ' HG21 ' B' ' 388' ' ' VAL . 1.0 OUTLIER -133.8 112.59 11.46 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.045 0.45 . . . . 0.0 110.472 179.326 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.441 ' SG ' ' O ' ' B' ' 427' ' ' ALA . 0.0 OUTLIER -94.51 108.61 20.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.506 179.186 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.53 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.2 OUTLIER -150.3 169.28 21.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.151 0.501 . . . . 0.0 111.413 -179.439 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.545 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 1.2 m -144.59 145.21 21.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.775 -179.57 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 67.43 2.44 20.63 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.907 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . 0.479 ' HA ' ' HD3' ' B' ' 405' ' ' ARG . 16.5 t70 71.14 13.69 6.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.726 0.298 . . . . 0.0 111.066 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -137.11 -6.62 1.65 Allowed Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.395 -0.907 . . . . 0.0 113.6 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.53 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 95.3 m -127.03 119.71 27.28 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 117.15 0.475 . . . . 0.0 111.547 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . 0.476 ' HA ' ' HB2' ' B' ' 405' ' ' ARG . 41.5 t -102.89 97.09 5.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-O 120.752 0.31 . . . . 0.0 110.75 179.432 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.529 ' N ' ' CD1' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -56.32 -22.48 30.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.696 -179.971 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 164.71 -165.66 37.6 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.405 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.473 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -152.12 152.67 32.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.775 0.321 . . . . 0.0 110.732 -179.916 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.49 ' HA2' ' HG2' ' B' ' 426' ' ' ARG . . . -133.58 149.72 19.74 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 119.75 -1.214 . . . . 0.0 113.379 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . 0.499 ' CG1' ' O ' ' B' ' 416' ' ' VAL . 3.8 p -148.26 118.88 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.776 0.322 . . . . 0.0 110.544 179.293 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.54 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -133.29 164.66 24.22 Favored Glycine 0 C--O 1.226 -0.347 0 C-N-CA 120.842 -0.694 . . . . 0.0 111.395 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.524 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.5 OUTLIER -79.88 -48.1 14.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 117.465 0.632 . . . . 0.0 111.316 -179.953 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.624 ' O ' ' CG2' ' B' ' 420' ' ' ILE . 0.2 OUTLIER -74.41 -23.62 58.98 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.758 -0.201 . . . . 0.0 111.096 -179.651 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.624 ' CG2' ' O ' ' B' ' 419' ' ' ASN . 0.9 OUTLIER 102.87 -43.61 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 C-N-CA 124.299 1.04 . . . . 0.0 109.946 -178.374 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.613 ' CD ' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -49.92 -54.59 18.76 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.032 -1.47 . . . . 0.0 107.032 178.605 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.613 ' N ' ' CD ' ' B' ' 421' ' ' LYS . 0.1 OUTLIER -53.21 -14.48 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.515 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.89 177.935 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.546 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -84.06 -49.14 9.19 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 107.22 -1.4 . . . . 0.0 107.22 176.487 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . 0.403 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -60.88 -54.17 39.15 Favored Glycine 0 C--N 1.336 0.534 0 N-CA-C 109.883 -1.287 . . . . 0.0 109.883 177.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . 0.515 ' CG2' ' O ' ' B' ' 365' ' ' SER . 8.9 mm -53.96 -68.28 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 177.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.593 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 2.6 tpt180 -39.93 -28.56 0.05 Allowed 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.101 179.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.441 ' O ' ' SG ' ' B' ' 404' ' ' CYS . . . -64.68 -55.1 22.22 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 177.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.601 ' CB ' ' CB ' ' B' ' 370' ' ' ALA . . . -59.84 -55.01 39.47 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.477 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.07 -11.92 0.53 Allowed 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.794 179.285 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.502 ' ND2' ' O ' ' B' ' 426' ' ' ARG . 1.4 m-80 -92.09 -32.04 15.31 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 177.668 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.426 ' O ' ' HE2' ' B' ' 437' ' ' MET . . . -71.93 -44.9 62.88 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.027 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.541 ' CB ' ' HG3' ' B' ' 373' ' ' GLN . 0.4 OUTLIER -85.1 11.1 10.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.015 -179.948 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . 0.523 ' O ' ' HG2' ' B' ' 433' ' ' ARG . 0.0 OUTLIER -80.27 -0.1 35.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.372 179.816 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . 0.464 ' O ' ' HG ' ' B' ' 438' ' ' LEU . 31.3 t0 -130.09 93.17 3.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.747 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.58 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -58.24 -39.7 79.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.867 -179.832 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.58 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 9.8 mtpt -57.27 -41.64 80.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.767 0.318 . . . . 0.0 110.414 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.477 ' CE ' ' HG ' ' B' ' 412' ' ' LEU . 33.7 ttp -74.67 -48.43 26.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.169 0.509 . . . . 0.0 109.811 179.059 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.522 ' CD1' ' HA ' ' B' ' 432' ' ' LEU . 94.1 mt -53.94 -64.42 0.83 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.192 178.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -51.95 -45.25 64.29 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.245 -0.888 . . . . 0.0 109.93 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.564 ' CE1' ' HG3' ' B' ' 444' ' ' GLN . 0.1 OUTLIER -45.2 -38.59 5.48 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 179.561 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.548 ' CE1' ' CE2' ' B' ' 440' ' ' PHE . 25.6 m-85 -74.44 -39.64 62.44 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.061 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -52.15 -60.52 3.11 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 178.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 8.7 tttp -50.7 -44.4 57.98 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.206 -0.665 . . . . 0.0 109.206 178.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.564 ' HG3' ' CE1' ' B' ' 440' ' ' PHE . 0.0 OUTLIER -55.18 -50.75 68.57 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.028 178.787 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.597 ' HD2' ' CD1' ' B' ' 380' ' ' TYR . 7.8 mmp_? -51.69 -36.65 47.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.793 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -75.19 -41.14 58.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.956 0.408 . . . . 0.0 110.442 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . 0.458 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -65.99 -56.64 10.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.288 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.548 ' CG1' ' O ' ' B' ' 445' ' ' ARG . 1.1 pt -29.5 136.69 0.16 Allowed Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.723 179.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -48.1 167.44 0.1 Allowed 'Trans proline' 0 N--CA 1.464 -0.254 0 C-N-CA 122.995 2.463 . . . . 0.0 112.427 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . 0.411 ' O ' ' O ' ' B' ' 451' ' ' SER . 42.4 mtt-85 -105.67 87.11 2.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.946 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 451' ' ' SER . . . . . 0.411 ' O ' ' O ' ' B' ' 450' ' ' ARG . 1.7 m -49.38 -179.87 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.716 179.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -170.01 39.13 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.096 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.915 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.815 " O2'" ' H8 ' ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.777 0 O4'-C1'-N19 111.493 3.293 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.815 ' H8 ' " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.438 1.989 0 O4'-C1'-N19 111.215 3.015 . 0.2 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.649 ' C2 ' ' C5 ' ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.78 1 C3'-C2'-C1' 105.105 4.006 OUTLIER-DELTA 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.649 ' C5 ' ' C2 ' ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.14 0 O4'-C1'-N19 111.303 3.103 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.77 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.115 0 O4'-C1'-N19 111.178 2.978 . 0.045 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.439 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.269 0 O4'-C1'-N19 111.04 2.84 . 0.143 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.685 ' H6 ' " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.039 0 O4'-C1'-N19 111.495 3.295 . 0.192 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.669 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.226 0 O4'-C1'-N19 110.988 2.788 . 0.322 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.669 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.403 0 C5'-C4'-C3' 111.364 -2.757 . 0.416 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.539 ' H6 ' " O5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 P--O5' 1.612 1.939 0 O4'-C1'-N19 111.198 2.998 . 0.081 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.632 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.165 0 O4'-C1'-N19 111.192 2.992 . 0.022 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.928 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 P--O5' 1.612 1.881 0 O4'-C1'-N19 111.066 2.866 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.928 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.599 0 C3'-C2'-C1' 104.565 3.405 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.708 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.597 0 C3'-C2'-C1' 104.273 3.081 . 0.181 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.708 " O4'" " H2'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.431 -1.812 0 C5'-C4'-C3' 111.036 -2.976 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.591 ' C8 ' ' C5 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.778 0 C5'-C4'-C3' 110.857 -3.095 . 0.384 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.607 " O2'" " C1'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.448 0 O4'-C1'-N19 111.194 2.994 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.641 ' N6 ' ' N3 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.432 -1.771 0 C5'-C4'-C3' 111.014 -2.991 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.458 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.238 0 O4'-C1'-N19 111.171 2.971 . 0.28 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.789 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.934 0 C5'-C4'-C3' 111.202 -2.865 . 0.131 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.789 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.395 0 O4'-C1'-N19 111.269 3.069 . 0.063 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.917 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.612 1.94 0 C5'-C4'-C3' 111.302 -2.799 . 0.015 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.799 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.254 0 O4'-C1'-N19 111.818 3.618 . 0.032 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.799 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 P--O5' 1.615 2.204 0 O4'-C1'-N19 110.863 2.663 . 0.125 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.43 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.185 0 O4'-C1'-N19 111.238 3.038 . 0.165 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.494 " O2'" " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.695 0 C5'-C4'-C3' 111.307 -2.795 . 0.098 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.843 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.138 0 C5'-C4'-C3' 111.353 -2.764 . 0.148 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.843 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.483 0 C3'-C2'-C1' 104.585 3.428 . 0.031 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.884 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.442 2.314 0 O4'-C1'-N19 111.202 3.002 . 0.191 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 0.891 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.279 0 O4'-C1'-N19 111.214 3.014 . 0.233 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 0.891 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.592 0 C3'-C2'-C1' 104.305 3.116 . 0.093 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . 0.589 " C5'" HO2' ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.556 0 C5'-C4'-C3' 111.271 -2.82 . 0.219 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . 0.504 ' O ' ' N ' ' B' ' 366' ' ' LEU . . . . . . . . 0 N--CA 1.49 2.255 0 N-CA-C 112.545 -0.222 . . . . 0.0 112.545 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 1.7 m -60.57 73.91 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.696 0.284 . . . . 0.0 110.902 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . 0.504 ' N ' ' O ' ' B' ' 364' ' ' GLY . 0.2 OUTLIER -129.81 120.54 25.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.886 0.374 . . . . 0.0 111.223 -179.698 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.518 ' CB ' HG13 ' B' ' 425' ' ' ILE . 0.0 OUTLIER -55.42 -71.08 0.09 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.601 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.467 ' HE2' ' OD1' ' B' ' 369' ' ' ASN . 3.3 tmm? -35.72 -43.79 0.3 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.999 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . 0.467 ' OD1' ' HE2' ' B' ' 368' ' ' MET . 87.1 m-20 -65.31 -42.9 92.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.896 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.548 ' O ' ' N ' ' B' ' 373' ' ' GLN . . . -62.76 -71.94 0.15 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.448 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.561 ' HG2' " O2'" ' A' ' 20' ' ' ' A' . 0.0 OUTLIER -35.82 -49.45 0.61 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.968 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.572 ' O ' ' CB ' ' B' ' 376' ' ' SER . 3.5 tmm_? -58.39 -37.03 74.45 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.924 0.393 . . . . 0.0 110.71 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.548 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -62.34 -48.61 79.05 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.219 0.533 . . . . 0.0 110.973 179.259 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.562 ' O ' ' N ' ' B' ' 379' ' ' GLY . 0.4 OUTLIER -62.42 -69.06 0.28 Allowed 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -178.127 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . 0.412 ' CG ' " H5'" ' A' ' 20' ' ' ' A' . 6.2 m-85 -70.83 -40.2 72.56 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -177.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.572 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.5 OUTLIER -71.9 -51.63 21.24 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.227 0.455 . . . . 0.0 112.227 -178.642 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.482 ' CD2' ' NH1' ' B' ' 372' ' ' ARG . 2.3 mm? -89.32 -23.25 22.31 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 114.733 1.383 . . . . 0.0 114.733 -176.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.522 ' O ' ' N ' ' B' ' 380' ' ' TYR . 20.8 mm -127.82 -74.77 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 119.219 0.918 . . . . 0.0 113.429 -178.018 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.562 ' N ' ' O ' ' B' ' 374' ' ' LEU . . . -51.61 80.43 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.176 0 CA-C-N 116.188 -0.46 . . . . 0.0 113.433 -178.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.637 ' CE1' ' O ' ' B' ' 382' ' ' SER . 14.5 p90 -102.05 173.18 6.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.757 0.313 . . . . 0.0 111.117 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . 0.442 ' C ' ' O ' ' B' ' 380' ' ' TYR . . . -28.07 -43.03 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.193 -179.281 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 382' ' ' SER . . . . . 0.637 ' O ' ' CE1' ' B' ' 380' ' ' TYR . 0.5 OUTLIER -114.39 132.34 56.26 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.839 -179.945 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.582 ' CB ' ' O ' ' B' ' 382' ' ' SER . 0.1 OUTLIER 151.31 -49.74 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.936 0.398 . . . . 0.0 110.479 -179.871 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . 0.527 ' N ' HD11 ' B' ' 383' ' ' LEU . 0.0 OUTLIER 69.88 73.75 0.23 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.064 178.708 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.58 ' HB2' ' CD1' ' B' ' 383' ' ' LEU . 6.0 tt -102.71 128.8 49.27 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 179.107 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . 0.478 ' O ' ' O ' ' B' ' 405' ' ' ARG . 14.9 p-80 -141.32 144.96 34.88 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.48 0.657 . . . . 0.0 112.761 -179.038 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.512 ' OH ' ' CD1' ' B' ' 374' ' ' LEU . 27.4 m-85 -103.06 145.93 29.15 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.748 178.633 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . 0.45 HG22 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -129.08 122.23 55.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.128 179.211 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.7 m -85.5 122.52 29.75 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.555 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.555 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 35.7 m -130.25 154.28 40.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.549 -179.808 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.555 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 9.0 tptt 95.07 23.01 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.326 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.532 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER 3.62 114.11 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.696 0 O-C-N 123.979 0.799 . . . . 0.0 112.192 179.931 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.476 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 34.5 Cg_exo -55.2 163.64 4.41 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.525 2.15 . . . . 0.0 113.226 -179.17 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 394' ' ' THR . . . . . 0.473 ' CG2' ' OD1' ' B' ' 397' ' ' ASP . 0.1 OUTLIER -131.33 177.22 7.64 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.706 -1.133 . . . . 0.0 111.738 -179.288 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -102.08 18.0 21.87 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.565 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . 0.496 ' O ' ' HB3' ' B' ' 397' ' ' ASP . 10.1 m -137.4 6.57 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.984 178.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . 0.496 ' HB3' ' O ' ' B' ' 396' ' ' VAL . 17.8 p-10 172.79 54.17 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.384 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.476 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 93.1 Cg_exo -33.34 -29.18 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.613 2.875 . . . . 0.0 113.566 -179.161 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.547 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 1.1 p-10 -31.65 125.41 0.24 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.189 0.519 . . . . 0.0 111.854 -178.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 400' ' ' SER . . . . . 0.46 ' HB2' ' HG3' ' B' ' 393' ' ' PRO . 29.1 t -133.92 157.01 47.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.914 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.545 ' CG1' ' O ' ' B' ' 415' ' ' GLY . 4.6 tt -114.85 151.58 16.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.14 0.495 . . . . 0.0 111.037 -179.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.437 ' O ' HG21 ' B' ' 414' ' ' THR . 0.4 OUTLIER -116.14 158.59 16.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.14 -178.971 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.45 ' CB ' HG22 ' B' ' 388' ' ' VAL . 3.6 mm-40 -122.79 118.37 27.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.884 179.012 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.512 ' O ' ' N ' ' B' ' 412' ' ' LEU . 8.9 t -96.77 100.04 11.6 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 179.056 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.624 ' HA ' ' O ' ' B' ' 410' ' ' THR . 13.1 ttp180 -140.35 162.73 34.59 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 121.033 0.444 . . . . 0.0 111.53 -179.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.54 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 2.0 m -146.5 -178.54 0.71 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.44 -179.328 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 58.86 -101.48 0.22 Allowed Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.914 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -156.95 18.37 0.31 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.874 0.368 . . . . 0.0 110.965 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 165.03 37.35 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.937 -0.649 . . . . 0.0 111.942 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.624 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 17.4 m -122.96 114.73 20.82 Favored 'General case' 0 C--O 1.217 -0.644 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 47.1 t -107.33 107.79 23.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.581 0.229 . . . . 0.0 111.047 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.531 ' CD2' HG11 ' B' ' 406' ' ' VAL . 0.6 OUTLIER -66.91 -27.87 67.85 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 179.324 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . 0.498 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 167.26 -168.19 40.3 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.211 -0.995 . . . . 0.0 113.004 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.459 ' C ' ' OD1' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -145.58 155.97 43.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.697 0.284 . . . . 0.0 111.211 -179.364 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.545 ' O ' ' CG1' ' B' ' 401' ' ' ILE . . . -148.3 151.89 24.03 Favored Glycine 0 C--O 1.223 -0.564 0 C-N-CA 120.227 -0.987 . . . . 0.0 113.22 -179.477 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . 0.407 ' HB ' HG13 ' B' ' 401' ' ' ILE . 3.5 p -139.12 148.86 23.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.731 0.301 . . . . 0.0 110.978 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.547 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -160.53 152.59 23.35 Favored Glycine 0 C--O 1.228 -0.24 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.16 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.529 ' N ' HD13 ' B' ' 422' ' ' ILE . 0.0 OUTLIER -68.81 -44.5 73.4 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.378 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.549 ' O ' ' N ' ' B' ' 421' ' ' LYS . 0.3 OUTLIER -98.05 32.08 2.52 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.185 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.606 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.4 OUTLIER 51.55 -47.43 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 178.59 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.614 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -44.91 -54.79 6.09 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -179.577 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.615 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.1 OUTLIER -50.39 -19.34 0.71 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.527 0 N-CA-C 109.9 -0.408 . . . . 0.0 109.9 178.486 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.606 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -83.23 -48.37 10.55 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 177.124 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -59.78 -52.36 53.42 Favored Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 177.666 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . 0.518 HG13 ' CB ' ' B' ' 367' ' ' ASP . 0.5 OUTLIER -57.61 -67.17 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 177.329 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.615 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 10.8 tpt180 -39.81 -30.19 0.08 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.096 178.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.487 ' HA ' ' OD1' ' B' ' 430' ' ' ASN . . . -60.71 -61.42 2.6 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.139 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.508 ' CB ' HD11 ' B' ' 374' ' ' LEU . . . -53.23 -49.84 66.0 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 177.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.519 ' O ' ' CD2' ' B' ' 432' ' ' LEU . 1.4 tt0 -47.51 -24.54 0.87 Allowed 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.431 178.639 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.498 ' HB3' ' HA3' ' B' ' 413' ' ' GLY . 14.2 m120 -81.71 -34.63 30.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.65 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.45 ' O ' HD21 ' B' ' 438' ' ' LEU . . . -69.84 -42.28 73.79 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.532 ' HA ' ' CD1' ' B' ' 438' ' ' LEU . 0.0 OUTLIER -83.66 9.62 11.2 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.889 -0.324 . . . . 0.0 111.408 -179.507 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . 0.426 ' HD3' ' O ' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -88.68 -9.75 50.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.163 -179.587 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . 0.48 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 76.7 m-20 -108.91 83.51 1.77 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.239 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.543 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 4.6 ptmm? -50.77 -53.38 32.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.027 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.543 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 10.0 mtpp -52.48 -43.98 65.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.736 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.48 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 14.3 tmm? -70.08 -50.52 40.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.964 0.412 . . . . 0.0 110.252 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.532 ' CD1' ' HA ' ' B' ' 432' ' ' LEU . 85.6 mt -52.77 -61.98 1.94 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.398 179.326 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -56.42 -44.13 80.08 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.032 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.453 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -42.29 -44.73 3.95 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.908 179.641 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.448 ' O ' ' HG2' ' B' ' 445' ' ' ARG . 49.9 m-85 -67.94 -44.49 76.71 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.62 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . 0.409 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -44.5 -60.54 1.92 Allowed 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 178.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 11.2 ttmt -47.76 -38.93 16.57 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.652 -0.703 . . . . 0.0 109.219 178.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.607 ' HG3' ' N ' ' B' ' 445' ' ' ARG . 0.0 OUTLIER -61.3 -51.32 69.38 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 178.512 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.611 ' CD ' ' CD1' ' B' ' 380' ' ' TYR . 0.3 OUTLIER -44.11 -43.95 7.26 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.993 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -80.59 -36.21 33.13 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.189 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . 0.46 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -63.31 -61.73 2.16 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.46 ' C ' ' O ' ' B' ' 447' ' ' ALA . 1.3 pt -28.16 139.74 0.09 OUTLIER Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.798 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . 0.436 ' O ' ' C ' ' B' ' 450' ' ' ARG . 96.5 Cg_endo -78.07 5.34 5.45 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.861 2.374 . . . . 0.0 112.359 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . 0.436 ' C ' ' O ' ' B' ' 449' ' ' PRO . 22.5 ptt180 33.1 49.59 0.19 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.303 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -166.27 160.12 15.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.027 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . 0.408 ' O ' ' OG ' ' B' ' 453' ' ' SER . 1.9 tm-20 -150.81 116.32 5.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.979 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 453' ' ' SER . . . . . 0.408 ' OG ' ' O ' ' B' ' 452' ' ' GLU . 1.6 m . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.981 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.44 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.437 1.906 0 C5'-C4'-C3' 110.976 -3.016 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.97 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.331 0 O4'-C1'-N19 111.26 3.06 . 0.234 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.97 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.17 0 O4'-C1'-N19 111.277 3.077 . 0.188 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.585 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.355 0 C5'-C4'-C3' 111.272 -2.819 . 0.053 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.704 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 P--O5' 1.613 1.976 0 O4'-C1'-N19 111.093 2.893 . 0.028 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.526 " O2'" " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.481 0 C5'-C4'-C3' 111.211 -2.859 . 0.088 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.71 ' H6 ' " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.928 0 O4'-C1'-N19 111.491 3.291 . 0.077 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.695 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.091 0 C5'-C4'-C3' 111.36 -2.76 . 0.087 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.695 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.579 0 C5'-C4'-C3' 111.073 -2.951 . 0.16 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.629 " C5'" " O2'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.342 0 C5'-C4'-C3' 110.97 -3.02 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.643 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.341 0 O4'-C1'-N19 111.369 3.169 . 0.033 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 1.0 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 P--O5' 1.614 2.06 0 O4'-C1'-N19 111.258 3.058 . 0.014 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 1.0 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.678 0 C3'-C2'-C1' 104.734 3.593 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.705 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.565 0 O4'-C1'-N19 111.592 3.392 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.705 " O4'" " H2'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.429 -1.983 0 C5'-C4'-C3' 111.087 -2.942 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.686 ' C8 ' ' C5 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.609 1.628 0 O4'-C1'-N19 111.386 3.186 . 0.128 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.715 " O2'" ' P ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.432 -1.753 0 O4'-C1'-N19 111.418 3.218 OUTLIER-EPSILON 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.715 ' P ' " O2'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.077 0 C5'-C4'-C3' 111.122 -2.918 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.615 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.142 0 O4'-C1'-N19 111.532 3.332 . 0.092 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.854 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.956 0 C5'-C4'-C3' 111.127 -2.915 . 0.178 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.854 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.515 0 C5'-C4'-C3' 111.085 -2.943 . 0.012 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.909 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.612 1.851 0 O4'-C1'-N19 111.244 3.044 . 0.017 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.672 " O2'" " C5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.167 0 O4'-C1'-N19 111.858 3.658 . 0.013 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.717 ' H6 ' " O5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.224 0 C5'-C4'-C3' 111.353 -2.765 . 0.059 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.485 ' O6 ' ' O4 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.223 0 O4'-C1'-N19 111.324 3.124 . 0.616 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.483 " O2'" " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.617 0 O4'-C1'-N19 111.087 2.887 . 0.083 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.791 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.012 0 C5'-C4'-C3' 111.234 -2.844 . 0.116 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.791 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.589 1 C3'-C2'-C1' 105.196 4.107 OUTLIER-DELTA 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.802 " H2'" " O4'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.043 0 O4'-C1'-N19 111.137 2.937 . 0.01 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 0.928 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.22 0 O4'-C1'-N19 111.556 3.356 . 0.131 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 0.928 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.726 0 C3'-C2'-C1' 104.643 3.492 . 0.045 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . 0.644 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.33 0 C5'-C4'-C3' 111.097 -2.935 . 0.268 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.248 0 N-CA-C 112.554 -0.218 . . . . 0.0 112.554 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 365' ' ' SER . . . . . 0.409 ' O ' ' OG ' ' B' ' 365' ' ' SER . 14.6 p -74.8 65.14 1.33 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.869 0.366 . . . . 0.0 110.894 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . 0.477 HD11 ' OD1' ' B' ' 369' ' ' ASN . 6.1 tp -114.08 13.43 18.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.369 0.604 . . . . 0.0 110.79 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.544 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.2 OUTLIER -44.75 -75.14 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.99 179.396 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.452 ' HE2' ' CG ' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -36.15 -44.2 0.38 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.666 179.779 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . 0.477 ' OD1' HD11 ' B' ' 366' ' ' LEU . 7.7 m120 -66.49 -38.36 87.11 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.921 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.546 ' O ' ' N ' ' B' ' 373' ' ' GLN . . . -61.31 -70.45 0.19 Allowed 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.831 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.539 ' HB3' " O2'" ' A' ' 20' ' ' ' A' . 0.0 OUTLIER -39.07 -42.17 0.88 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.061 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.559 ' O ' ' CB ' ' B' ' 376' ' ' SER . 3.0 tmt_? -53.49 -43.28 68.1 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.73 179.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.546 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -64.43 -60.93 2.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.485 179.212 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.535 HD11 ' CB ' ' B' ' 428' ' ' ALA . 0.7 OUTLIER -45.8 -74.4 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 -178.474 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . 0.407 ' HB2' " C5'" ' A' ' 20' ' ' ' A' . 3.8 m-30 -95.56 -4.7 44.21 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -176.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.559 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -108.84 1.15 20.7 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.044 -0.662 . . . . 0.0 110.337 179.017 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 0.2 OUTLIER -133.88 -40.16 0.86 Allowed 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 178.215 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.463 ' C ' ' O ' ' B' ' 374' ' ' LEU . 2.1 mm -129.37 -144.88 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.609 179.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.465 ' HA2' HD22 ' B' ' 383' ' ' LEU . . . 40.65 66.61 0.83 Allowed Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.993 -0.622 . . . . 0.0 113.701 179.026 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.585 ' CZ ' ' HB3' ' B' ' 383' ' ' LEU . 30.9 p90 -77.12 -4.03 42.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.802 0.301 . . . . 0.0 110.569 179.04 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . 0.55 ' CB ' ' O ' ' B' ' 380' ' ' TYR . . . 95.15 -38.53 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 178.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 382' ' ' SER . . . . . 0.448 ' HB3' ' CE2' ' B' ' 380' ' ' TYR . 11.1 t -86.59 24.9 1.33 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.172 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.585 ' HB3' ' CZ ' ' B' ' 380' ' ' TYR . 0.4 OUTLIER -114.31 -5.8 12.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.699 0.285 . . . . 0.0 111.064 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . 0.432 ' O ' HG13 ' B' ' 406' ' ' VAL . 14.5 tpp180 63.68 59.14 1.2 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.994 0.426 . . . . 0.0 110.693 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.568 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 7.8 tt -114.43 133.11 55.97 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.907 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 6.2 p-80 -158.85 160.73 36.51 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.631 0.729 . . . . 0.0 112.785 -179.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.522 ' CE2' ' HB3' ' B' ' 404' ' ' CYS . 8.0 m-85 -108.09 145.72 33.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.624 -1.171 . . . . 0.0 110.511 178.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -127.86 125.56 65.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.536 179.108 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.6 m -86.14 123.87 31.91 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.499 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.513 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 19.6 m -129.89 156.97 42.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.01 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.513 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 86.49 19.9 0.08 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.036 179.868 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.509 ' C ' ' O ' ' B' ' 391' ' ' LYS . 1.3 mmmt -2.76 122.66 0.0 OUTLIER Pre-proline 0 N--CA 1.471 0.616 0 O-C-N 124.194 0.934 . . . . 0.0 112.551 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.51 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 12.4 Cg_exo -66.24 157.48 59.76 Favored 'Trans proline' 0 N--CA 1.464 -0.24 0 C-N-CA 122.695 2.263 . . . . 0.0 113.282 -179.577 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 394' ' ' THR . . . . . 0.473 ' O ' ' HD3' ' B' ' 398' ' ' PRO . 0.3 OUTLIER -148.64 166.34 28.63 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.798 -1.092 . . . . 0.0 111.472 -179.764 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -82.69 10.13 8.16 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-O 121.089 0.471 . . . . 0.0 110.812 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . 0.55 ' CG1' HO2' ' A' ' 30' ' ' ' C' . 27.2 m -132.67 15.04 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.386 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 165.73 57.46 0.0 OUTLIER Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 114.581 -1.19 . . . . 0.0 109.335 -179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.51 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 1.0 OUTLIER -42.95 -54.64 3.24 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 123.483 2.789 . . . . 0.0 111.715 179.981 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.516 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 6.7 m120 -19.54 130.51 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.837 -1.074 . . . . 0.0 112.002 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -140.25 150.49 44.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.898 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.541 HG13 ' N ' ' B' ' 402' ' ' VAL . 0.5 OUTLIER -115.44 143.98 24.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.985 -179.714 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.541 ' N ' HG13 ' B' ' 401' ' ' ILE . 1.5 t -108.65 159.62 7.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.949 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -134.03 123.35 24.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.442 179.568 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.527 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.1 OUTLIER -111.08 113.04 25.27 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 179.27 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.582 ' HA ' ' O ' ' B' ' 410' ' ' THR . 3.1 ptt180 -141.26 171.73 13.67 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 123.389 0.431 . . . . 0.0 111.675 -179.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.568 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -139.32 166.7 21.18 Favored 'Isoleucine or valine' 0 C--O 1.239 0.536 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.383 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . 0.592 ' O ' ' CB ' ' B' ' 408' ' ' ASP . . . -45.26 103.3 0.05 OUTLIER Glycine 0 C--N 1.338 0.686 0 CA-C-N 114.879 -1.055 . . . . 0.0 113.335 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . 0.592 ' CB ' ' O ' ' B' ' 407' ' ' GLY . 3.8 t70 137.21 -9.14 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 123.796 0.838 . . . . 0.0 109.745 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 88.81 19.04 53.14 Favored Glycine 0 N--CA 1.442 -0.904 0 N-CA-C 110.876 -0.89 . . . . 0.0 110.876 -179.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.582 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 34.7 m -82.49 125.49 31.16 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . 0.467 HG13 ' O ' ' B' ' 404' ' ' CYS . 26.8 t -103.09 110.79 30.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 120.678 0.275 . . . . 0.0 110.301 179.535 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.527 ' N ' ' O ' ' B' ' 404' ' ' CYS . 0.3 OUTLIER -64.07 -28.91 70.11 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.286 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 167.58 -169.03 40.95 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.162 -1.018 . . . . 0.0 112.749 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.485 ' N ' ' OD1' ' B' ' 430' ' ' ASN . 3.5 t -156.0 148.76 24.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.909 0.385 . . . . 0.0 110.949 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.517 ' CA ' ' CG ' ' B' ' 426' ' ' ARG . . . -131.6 162.42 23.75 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.261 -0.971 . . . . 0.0 113.279 -179.569 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . 0.451 ' HB ' HD13 ' B' ' 401' ' ' ILE . 3.5 p -142.57 150.4 18.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.689 -0.256 . . . . 0.0 110.731 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.554 ' HA3' ' CD1' ' B' ' 422' ' ' ILE . . . -172.57 150.0 12.18 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.165 -1.017 . . . . 0.0 113.008 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.519 ' N ' HD13 ' B' ' 422' ' ' ILE . 0.0 OUTLIER -69.73 -43.28 72.64 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.822 0.344 . . . . 0.0 111.894 -179.701 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.571 ' O ' ' N ' ' B' ' 421' ' ' LYS . 6.0 t30 -97.06 29.19 3.21 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.608 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 51.38 -45.43 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 178.401 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.632 ' CD ' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -43.95 -54.36 5.43 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 -179.92 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.632 ' N ' ' CD ' ' B' ' 421' ' ' LYS . 0.0 OUTLIER -48.07 -21.04 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.057 178.551 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.608 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -83.57 -47.71 11.02 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 177.35 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . 0.478 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -59.63 -52.23 54.28 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 110.136 -1.186 . . . . 0.0 110.136 177.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . 0.462 ' CD1' ' HB3' ' B' ' 367' ' ' ASP . 4.8 mm -58.46 -67.15 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 177.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.579 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 24.2 tpt180 -38.01 -31.31 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.186 178.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.492 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -62.93 -57.59 10.27 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 178.434 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.54 ' O ' ' CD2' ' B' ' 432' ' ' LEU . . . -55.76 -52.39 64.12 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.67 178.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.402 ' OE1' HG23 ' B' ' 425' ' ' ILE . 0.7 OUTLIER -56.63 -18.25 11.43 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.706 179.369 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.9 OUTLIER -79.85 -40.8 27.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.407 178.862 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.468 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -67.46 -35.03 78.39 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.376 -179.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.54 ' CD2' ' O ' ' B' ' 428' ' ' ALA . 0.2 OUTLIER -86.98 10.96 14.77 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.682 179.786 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -85.0 -9.07 58.42 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.079 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . 0.525 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 62.7 m-20 -115.65 80.01 1.38 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.021 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.55 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 7.7 ptpt -48.92 -53.03 21.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.846 0.355 . . . . 0.0 110.278 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.55 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.2 OUTLIER -53.19 -42.42 66.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.551 179.809 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.525 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 0.8 OUTLIER -71.12 -45.77 62.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.24 0.543 . . . . 0.0 109.598 179.085 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . . . . . . . . . 76.9 mt -52.64 -59.88 3.93 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.461 178.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -56.6 -44.26 80.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.007 -0.997 . . . . 0.0 109.718 178.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.524 ' CD1' ' C ' ' B' ' 440' ' ' PHE . 0.2 OUTLIER -43.38 -43.95 5.41 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.564 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.574 ' CE1' HD12 ' B' ' 383' ' ' LEU . 49.7 m-85 -66.37 -46.12 77.78 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.47 179.226 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . 0.441 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -42.27 -60.64 1.4 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 178.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -49.09 -47.43 45.16 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.503 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -52.75 -58.78 5.75 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.485 179.157 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.554 ' HG2' ' CD1' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -42.73 -38.78 2.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.68 179.504 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -74.63 -36.8 62.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.637 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . 0.461 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -65.84 -63.15 1.15 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.446 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.491 ' CG1' ' O ' ' B' ' 445' ' ' ARG . 1.2 pp -29.39 119.02 0.29 Allowed Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.574 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . 0.481 ' O ' ' HB2' ' B' ' 450' ' ' ARG . 95.2 Cg_exo -44.98 -48.5 10.85 Favored 'Trans proline' 0 N--CA 1.464 -0.212 0 C-N-CA 122.862 2.374 . . . . 0.0 112.563 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . 0.481 ' HB2' ' O ' ' B' ' 449' ' ' PRO . 2.9 ttt-85 170.49 -67.59 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.014 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 77.9 p -118.93 -169.0 1.65 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.062 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -122.89 179.04 4.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.886 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.899 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.909 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.434 1.677 0 O4'-C1'-N19 111.335 3.135 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.909 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.443 2.407 0 O4'-C1'-N19 111.335 3.135 . 0.207 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.575 " O2'" " O5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.436 0 O4'-C1'-N19 111.116 2.916 . 0.212 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.671 ' C6 ' ' C4 ' ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.038 0 O4'-C1'-N19 110.909 2.709 . 0.144 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.671 ' C4 ' ' C6 ' ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.078 0 O4'-C1'-N19 111.289 3.089 . 0.427 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.451 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.429 -2.026 0 O4'-C1'-N19 111.088 2.888 . 0.043 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.693 ' H6 ' " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.998 0 O4'-C1'-N19 111.25 3.05 . 0.112 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.59 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.217 0 O4'-C1'-N19 110.965 2.765 . 0.188 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.59 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.253 0 O4'-C1'-N19 111.152 2.952 . 0.075 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.746 ' H6 ' " O5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 P--O5' 1.611 1.792 0 C5'-C4'-C3' 110.994 -3.004 . 0.084 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.616 " C5'" " O2'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.366 0 C5'-C4'-C3' 111.263 -2.825 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.806 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.435 1.745 0 C5'-C4'-C3' 110.987 -3.009 . 0.073 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.806 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.547 0 C3'-C2'-C1' 104.739 3.599 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.646 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.331 0 O4'-C1'-N19 111.226 3.026 . 0.112 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.788 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.43 -1.919 0 C5'-C4'-C3' 110.945 -3.037 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.788 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.431 -1.801 0 O4'-C1'-N19 111.318 3.118 . 0.286 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.478 " O2'" " O4'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.302 0 C5'-C4'-C3' 110.848 -3.102 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.661 ' N6 ' ' N3 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.656 0 C5'-C4'-C3' 110.869 -3.088 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.566 " O2'" " O4'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.303 0 C5'-C4'-C3' 111.174 -2.884 . 0.263 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.566 " O4'" " O2'" ' A' ' 19' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.436 1.809 0 C5'-C4'-C3' 110.906 -3.062 . 0.238 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.544 " O2'" " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.49 0 C3'-C2'-C1' 104.293 3.103 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.889 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.042 0 O4'-C1'-N19 111.183 2.983 . 0.014 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.601 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.428 -2.109 0 O4'-C1'-N19 111.695 3.495 . 0.056 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.865 ' H6 ' " O5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.082 0 C5'-C4'-C3' 111.526 -2.649 . 0.076 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.44 2.173 0 O4'-C1'-N19 111.144 2.944 . 0.265 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.435 " H2'" ' C6 ' ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.189 0 O4'-C1'-N19 111.235 3.035 . 0.125 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.642 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 1.967 0 O4'-C1'-N19 111.053 2.853 . 0.416 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.642 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.432 0 C3'-C2'-C1' 104.271 3.079 . 0.058 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 1.039 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.247 0 O4'-C1'-N19 111.055 2.855 . 0.123 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 1.039 " H5'" " O2'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.249 0 O4'-C1'-N19 111.435 3.235 . 0.176 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 0.945 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.76 0 O4'-C1'-N19 111.243 3.043 . 0.1 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.569 0 C5'-C4'-C3' 111.251 -2.833 . 0.134 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . 0.527 ' O ' ' CB ' ' B' ' 365' ' ' SER . . . . . . . . 0 N--CA 1.489 2.173 0 N-CA-C 112.536 -0.226 . . . . 0.0 112.536 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 365' ' ' SER . . . . . 0.527 ' CB ' ' O ' ' B' ' 364' ' ' GLY . 1.0 OUTLIER 86.27 27.42 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.868 0.366 . . . . 0.0 110.996 179.949 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . 0.559 HD13 ' ND2' ' B' ' 369' ' ' ASN . 2.2 tp -89.52 3.76 51.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.374 0.606 . . . . 0.0 111.26 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.516 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -38.27 -72.7 0.06 Allowed 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.625 179.015 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.527 ' HE2' ' ND2' ' B' ' 369' ' ' ASN . 0.3 OUTLIER -37.66 -36.88 0.19 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.052 179.813 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . 0.559 ' ND2' HD13 ' B' ' 366' ' ' LEU . 7.7 m-80 -63.79 -43.29 96.79 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.597 ' O ' ' N ' ' B' ' 373' ' ' GLN . . . -60.55 -68.68 0.28 Allowed 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.514 ' HE2' ' N ' ' B' ' 368' ' ' MET . 0.1 OUTLIER -34.03 -49.39 0.35 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.711 -179.844 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.546 ' O ' ' CB ' ' B' ' 376' ' ' SER . 5.0 tmm_? -60.65 -36.59 79.05 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.922 179.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.597 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -63.9 -49.81 71.21 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.88 179.581 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.458 HD11 ' OH ' ' B' ' 387' ' ' TYR . 0.4 OUTLIER -58.51 -67.04 0.4 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.607 -178.843 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . 0.502 ' O ' ' HA3' ' B' ' 379' ' ' GLY . 3.3 m-85 -71.51 -50.79 27.97 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -177.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.546 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.5 OUTLIER -66.57 -53.97 28.73 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -178.789 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.472 ' HG ' ' OE1' ' B' ' 373' ' ' GLN . 0.1 OUTLIER -76.06 -38.27 57.3 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 -178.466 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.471 HG13 HD23 ' B' ' 438' ' ' LEU . 4.8 mm -131.79 38.84 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.064 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.502 ' HA3' ' O ' ' B' ' 375' ' ' TYR . . . -121.99 63.15 0.52 Allowed Glycine 0 N--CA 1.453 -0.181 0 C-N-CA 120.372 -0.918 . . . . 0.0 112.552 179.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.571 ' O ' ' CB ' ' B' ' 381' ' ' ALA . 3.0 p90 -86.05 -3.23 58.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.527 0.204 . . . . 0.0 111.1 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . 0.589 ' O ' ' N ' ' B' ' 383' ' ' LEU . . . 99.05 -171.05 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.592 -179.277 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 382' ' ' SER . . . . . 0.443 ' C ' ' O ' ' B' ' 381' ' ' ALA . 10.4 m 26.2 35.68 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.542 -0.754 . . . . 0.0 112.038 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.589 ' N ' ' O ' ' B' ' 381' ' ' ALA . 0.8 OUTLIER -103.21 -24.88 13.53 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.836 0.35 . . . . 0.0 110.914 -179.398 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . 0.485 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 3.5 tpt85 61.05 51.74 4.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.227 179.657 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.525 ' HG ' ' CG1' ' B' ' 406' ' ' VAL . 7.8 tt -94.87 123.99 38.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.067 179.229 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . 0.496 ' O ' ' O ' ' B' ' 405' ' ' ARG . 2.2 p-80 -148.34 151.67 35.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.855 0.836 . . . . 0.0 113.179 -178.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.509 ' CZ ' ' SG ' ' B' ' 404' ' ' CYS . 8.1 m-85 -105.45 156.66 17.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.724 -1.125 . . . . 0.0 110.11 178.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . 0.54 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -133.98 124.52 46.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.236 0.541 . . . . 0.0 110.847 179.588 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -85.21 119.93 26.14 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.439 -179.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.52 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 32.8 m -130.86 151.91 36.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.365 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.53 ' O ' ' C ' ' B' ' 392' ' ' LYS . 0.1 OUTLIER 85.2 16.02 0.16 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.335 179.638 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.53 ' C ' ' O ' ' B' ' 391' ' ' LYS . 22.3 mmtt -3.51 121.63 0.0 OUTLIER Pre-proline 0 N--CA 1.472 0.674 0 O-C-N 123.987 0.805 . . . . 0.0 112.348 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.501 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 25.5 Cg_exo -56.61 162.62 8.07 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.412 2.075 . . . . 0.0 112.788 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 394' ' ' THR . . . . . 0.465 ' O ' ' HD3' ' B' ' 398' ' ' PRO . 1.1 p -156.5 168.57 26.95 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.399 -0.818 . . . . 0.0 111.73 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -81.24 8.03 9.93 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.103 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . 0.456 ' O ' ' HB2' ' B' ' 397' ' ' ASP . 24.2 m -132.11 14.83 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.448 0.642 . . . . 0.0 109.578 178.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . 0.456 ' HB2' ' O ' ' B' ' 396' ' ' VAL . 0.1 OUTLIER 166.03 58.33 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.765 -179.644 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.501 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 5.2 Cg_exo -39.86 -52.69 2.63 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 123.525 2.817 . . . . 0.0 112.281 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.525 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.8 OUTLIER -25.11 132.14 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.323 -0.853 . . . . 0.0 112.113 -178.84 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 400' ' ' SER . . . . . 0.469 ' HB2' ' HG3' ' B' ' 393' ' ' PRO . 18.4 t -135.86 144.52 45.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.951 179.565 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.522 HG13 ' N ' ' B' ' 402' ' ' VAL . 0.2 OUTLIER -112.27 139.46 36.85 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 CA-C-O 120.949 0.404 . . . . 0.0 110.662 -179.861 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.522 ' N ' HG13 ' B' ' 401' ' ' ILE . 0.7 OUTLIER -100.01 161.23 3.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.773 -179.669 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.54 ' CB ' HG23 ' B' ' 388' ' ' VAL . 2.8 mm-40 -128.13 109.05 11.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.528 178.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.509 ' SG ' ' CZ ' ' B' ' 387' ' ' TYR . 10.6 t -97.62 108.24 20.92 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.583 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.553 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -153.59 173.46 15.73 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.141 0.496 . . . . 0.0 111.532 -179.321 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.525 ' CG1' ' HG ' ' B' ' 385' ' ' LEU . 1.4 m -150.85 -175.84 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.989 -179.282 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . 0.409 ' N ' HG21 ' B' ' 406' ' ' VAL . . . 55.74 -103.85 0.27 Allowed Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.379 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -157.87 19.33 0.26 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.944 0.402 . . . . 0.0 110.883 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 173.05 25.52 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.878 -0.677 . . . . 0.0 113.145 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.553 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 24.4 m -113.17 110.3 20.19 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 117.102 0.451 . . . . 0.0 110.607 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . 0.433 ' HA ' ' HB3' ' B' ' 405' ' ' ARG . 10.5 t -102.33 95.48 3.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.678 0.275 . . . . 0.0 111.346 -179.712 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.492 ' N ' ' CD1' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -56.28 -22.34 29.54 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.933 0.397 . . . . 0.0 110.009 179.466 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 164.68 -167.38 38.45 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.485 -0.864 . . . . 0.0 112.729 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.437 ' C ' ' OD1' ' B' ' 430' ' ' ASN . 0.1 OUTLIER -153.53 148.14 26.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.887 0.375 . . . . 0.0 110.872 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.494 ' O ' HD13 ' B' ' 401' ' ' ILE . . . -130.91 151.24 19.55 Favored Glycine 0 C--O 1.225 -0.449 0 C-N-CA 120.187 -1.006 . . . . 0.0 113.149 -179.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . 0.416 ' CG2' ' HB ' ' B' ' 401' ' ' ILE . 1.9 p -152.11 126.13 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.134 0.492 . . . . 0.0 111.554 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.525 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -138.24 170.1 23.98 Favored Glycine 0 N--CA 1.449 -0.464 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.834 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.51 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 0.6 OUTLIER -83.88 -47.42 11.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.977 0.388 . . . . 0.0 111.572 -179.69 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.638 ' O ' ' CG2' ' B' ' 420' ' ' ILE . 0.2 OUTLIER -80.17 -25.77 39.63 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.53 -179.579 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.638 ' CG2' ' O ' ' B' ' 419' ' ' ASN . 1.5 pp 112.23 -43.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 124.703 1.201 . . . . 0.0 110.138 -179.138 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.488 ' HE2' " O3'" ' A' ' 22' ' ' ' C' . 0.3 OUTLIER -45.8 -59.15 2.96 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 179.382 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.616 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.0 OUTLIER -47.63 -16.75 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.473 0 CA-C-N 114.992 -1.003 . . . . 0.0 109.862 177.685 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.557 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -87.2 -49.89 6.98 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 177.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.12 -44.36 94.81 Favored Glycine 0 C--N 1.338 0.68 0 C-N-CA 119.776 -1.202 . . . . 0.0 110.503 178.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . 0.545 ' CD1' ' N ' ' B' ' 425' ' ' ILE . 1.1 mm -68.46 -65.03 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.277 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.616 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 12.9 tpt180 -40.17 -28.51 0.06 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.026 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.491 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -75.19 -52.96 9.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.714 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.551 ' CB ' ' HB3' ' B' ' 370' ' ' ALA . . . -50.32 -50.5 50.68 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.411 0.624 . . . . 0.0 109.439 178.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.589 ' O ' ' N ' ' B' ' 432' ' ' LEU . 57.8 mt-10 -60.19 -60.21 4.18 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 177.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.524 ' C ' ' O ' ' B' ' 429' ' ' GLU . 3.8 m120 -24.41 -45.73 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.308 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.517 ' N ' ' O ' ' B' ' 429' ' ' GLU . . . -70.63 -54.46 11.89 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-O 121.129 0.49 . . . . 0.0 110.103 178.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.6 ' C ' ' CD2' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -73.7 3.12 6.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.198 178.956 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . 0.498 ' N ' ' O ' ' B' ' 429' ' ' GLU . 0.8 OUTLIER -87.21 -8.48 56.8 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.851 -179.104 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . 0.482 ' OD2' ' CB ' ' B' ' 437' ' ' MET . 48.0 t0 -115.84 93.05 4.09 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.784 0.326 . . . . 0.0 110.905 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.589 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 0.6 OUTLIER -61.03 -42.2 98.02 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.178 -0.464 . . . . 0.0 109.875 179.54 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.589 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 25.4 mttt -54.61 -48.28 72.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.387 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.482 ' CB ' ' OD2' ' B' ' 434' ' ' ASP . 13.1 tmm? -71.46 -50.14 34.55 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.285 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.535 ' CD1' ' HA ' ' B' ' 432' ' ' LEU . 74.9 mt -50.81 -60.87 2.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.43 0.633 . . . . 0.0 110.123 179.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . 0.412 ' O ' ' N ' ' B' ' 442' ' ' ALA . 11.3 t70 -59.09 -41.5 88.22 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.321 178.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.529 ' CD1' ' C ' ' B' ' 440' ' ' PHE . 0.0 OUTLIER -44.04 -46.56 8.5 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 179.49 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.513 ' O ' ' CG ' ' B' ' 444' ' ' GLN . 55.9 m-85 -66.96 -39.78 87.32 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.22 179.042 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . 0.412 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -46.98 -60.16 2.63 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 177.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -47.32 -40.63 17.51 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.121 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.644 ' HG3' ' N ' ' B' ' 445' ' ' ARG . 0.0 OUTLIER -58.23 -52.15 66.78 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.678 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.644 ' N ' ' HG3' ' B' ' 444' ' ' GLN . 0.4 OUTLIER -45.74 -42.18 11.58 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.744 179.813 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -71.74 -38.29 70.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.09 0.472 . . . . 0.0 110.209 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . 0.51 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -73.95 -77.66 0.11 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.047 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.517 ' CG1' ' O ' ' B' ' 445' ' ' ARG . 0.5 OUTLIER 20.01 92.75 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.278 0 O-C-N 123.721 0.638 . . . . 0.0 111.897 -179.808 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_exo -41.65 161.82 0.03 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.924 2.416 . . . . 0.0 112.591 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.33 -4.42 45.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.854 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.72 120.14 32.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.678 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 51.3 102.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.027 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.972 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.588 " O2'" " O5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.513 0 O4'-C1'-N19 111.418 3.218 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.588 " O5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.112 0 O4'-C1'-N19 111.08 2.88 . 0.141 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.597 " O2'" " O5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.766 0 C3'-C2'-C1' 104.97 3.855 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.597 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 P--O5' 1.614 2.102 0 O4'-C1'-N19 111.07 2.87 . 0.048 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.465 ' C6 ' " H2'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.442 2.297 0 O4'-C1'-N19 111.383 3.183 . 0.141 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.563 " O2'" " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.409 0 O4'-C1'-N19 111.285 3.085 . 0.193 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.631 ' H6 ' " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 P--O5' 1.614 2.145 0 O4'-C1'-N19 111.249 3.049 . 0.078 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.656 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.207 0 O4'-C1'-N19 111.0 2.8 . 0.147 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.767 " O2'" " H5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.379 0 O4'-C1'-N19 110.983 2.783 . 0.166 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.767 " H5'" " O2'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.697 0 C3'-C2'-C1' 104.652 3.502 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.637 ' C2 ' ' C2 ' ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.64 0 C5'-C4'-C3' 111.089 -2.941 . 0.011 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.842 " O5'" ' H6 ' ' A' ' 12' ' ' ' U' . . . . . . . . 0 P--O5' 1.611 1.791 0 C5'-C4'-C3' 110.913 -3.058 . 0.014 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.768 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.651 0 C3'-C2'-C1' 104.817 3.685 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.741 ' C5 ' ' C8 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.447 0 O4'-C1'-N19 110.875 2.675 . 0.029 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.741 ' C8 ' ' C5 ' ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.455 0 C5'-C4'-C3' 111.014 -2.991 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.598 ' OP2' ' N2 ' ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.432 -1.764 0 O4'-C1'-N19 111.417 3.217 . 0.024 1t . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.617 HO2' ' P ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.485 0 C3'-C2'-C1' 104.584 3.426 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.685 ' N1 ' " O2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.804 0 C5'-C4'-C3' 110.806 -3.129 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.665 ' C2 ' ' NH2' ' B' ' 372' ' ' ARG . . . . . . . . 0 O4'--C4' 1.427 -2.132 0 O4'-C1'-N19 111.492 3.292 . 0.308 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.965 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.435 1.737 0 C5'-C4'-C3' 111.006 -2.996 . 0.083 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.965 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.556 0 C3'-C2'-C1' 104.557 3.397 . 0.051 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.783 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.025 0 O4'-C1'-N19 111.109 2.909 . 0.158 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.805 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.29 0 O4'-C1'-N19 111.318 3.118 . 0.074 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.805 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.681 0 C3'-C2'-C1' 105.01 3.9 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.644 ' P ' HO2' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.339 0 O4'-C1'-N19 111.206 3.006 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.493 " O2'" " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.448 0 O4'-C1'-N19 111.214 3.014 . 0.214 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.759 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.075 0 O4'-C1'-N19 110.976 2.776 . 0.158 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.759 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.37 0 C3'-C2'-C1' 104.874 3.749 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.908 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.442 2.296 0 O4'-C1'-N19 111.116 2.916 . 0.052 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 0.908 " H5'" " O2'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.332 0 O4'-C1'-N19 111.61 3.41 . 0.266 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 0.776 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.549 0 O4'-C1'-N19 111.383 3.183 . 0.174 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . 0.588 " O4'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.294 0 O4'-C1'-N19 111.131 2.931 . 0.15 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . 0.449 ' O ' ' CB ' ' B' ' 365' ' ' SER . . . . . . . . 0 N--CA 1.488 2.162 0 N-CA-C 112.43 -0.268 . . . . 0.0 112.43 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 365' ' ' SER . . . . . 0.449 ' CB ' ' O ' ' B' ' 364' ' ' GLY . 0.1 OUTLIER 80.1 50.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.774 0.321 . . . . 0.0 110.989 179.787 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . 0.463 HD23 ' ND2' ' B' ' 369' ' ' ASN . 1.2 mp -128.09 124.04 36.02 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.056 0.455 . . . . 0.0 111.508 -179.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.5 ' HB3' ' CG1' ' B' ' 425' ' ' ILE . 0.3 OUTLIER -54.75 -71.23 0.08 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.213 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.447 ' C ' ' O ' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -32.39 -49.36 0.2 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.931 179.805 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . 0.463 ' ND2' HD23 ' B' ' 366' ' ' LEU . 57.2 m-20 -62.14 -47.42 84.64 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.685 -179.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.571 ' CB ' ' CB ' ' B' ' 428' ' ' ALA . . . -61.64 -71.14 0.16 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.656 0.265 . . . . 0.0 110.303 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.505 ' NZ ' ' H22' ' A' ' 19' ' ' ' G' . 0.2 OUTLIER -33.09 -46.46 0.16 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.038 179.849 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.666 ' CZ ' ' C2 ' ' A' ' 18' ' ' ' A' . 0.0 OUTLIER -66.69 -38.31 86.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.648 -179.484 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.528 ' N ' ' O ' ' B' ' 370' ' ' ALA . 3.8 tm0? -61.63 -59.02 5.84 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.352 0.596 . . . . 0.0 110.639 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.475 ' O ' ' C ' ' B' ' 378' ' ' ILE . 2.3 mm? -58.18 -65.34 0.66 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.9 -1.046 . . . . 0.0 112.749 -178.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . 0.494 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 63.2 m-85 -73.64 -42.37 61.5 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -177.351 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.554 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -78.36 -52.9 7.9 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.503 -0.479 . . . . 0.0 111.671 -179.267 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.489 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.6 OUTLIER -76.32 -31.28 58.08 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -178.376 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.475 ' C ' ' O ' ' B' ' 374' ' ' LEU . 4.3 mm -141.56 39.12 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.81 -179.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.494 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -115.34 94.24 0.65 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.351 -0.928 . . . . 0.0 113.338 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.596 ' CE2' ' HB2' ' B' ' 382' ' ' SER . 0.4 OUTLIER -145.77 -178.11 5.94 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.278 -0.268 . . . . 0.0 110.278 179.448 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -91.76 75.92 5.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.9 0.381 . . . . 0.0 111.373 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 382' ' ' SER . . . . . 0.596 ' HB2' ' CE2' ' B' ' 380' ' ' TYR . 0.7 OUTLIER -170.31 -68.68 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.864 179.686 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.603 ' HB2' ' CE2' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -51.12 -41.4 60.03 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.183 -0.302 . . . . 0.0 110.183 179.612 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . 0.463 ' C ' HD21 ' B' ' 383' ' ' LEU . 2.1 tpt85 72.78 89.41 0.09 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 178.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.54 HD23 ' CD1' ' B' ' 387' ' ' TYR . 0.1 OUTLIER -63.89 147.08 52.77 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.647 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . 0.538 ' CB ' ' O ' ' B' ' 405' ' ' ARG . 0.1 OUTLIER -147.94 70.18 1.14 Allowed 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -178.943 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.54 ' CD1' HD23 ' B' ' 385' ' ' LEU . 4.0 m-85 -91.59 113.65 25.97 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.383 177.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . 0.436 HG23 ' HB3' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -109.28 133.11 55.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.735 0.302 . . . . 0.0 110.706 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 5.3 m -87.76 125.35 34.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.0 0.429 . . . . 0.0 110.536 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.525 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 27.1 m -131.38 159.68 42.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.582 -179.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.525 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 88.4 23.48 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.45 179.41 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.519 ' O ' ' O ' ' B' ' 391' ' ' LYS . 9.6 mmtt 1.78 118.28 0.0 OUTLIER Pre-proline 0 N--CA 1.472 0.673 0 O-C-N 124.249 0.968 . . . . 0.0 112.476 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.483 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 22.8 Cg_exo -61.01 162.59 18.78 Favored 'Trans proline' 0 N--CA 1.463 -0.272 0 C-N-CA 122.677 2.251 . . . . 0.0 113.153 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 2.9 p -127.82 170.46 12.76 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.768 -1.106 . . . . 0.0 111.194 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . 0.573 ' O ' " O2'" ' A' ' 30' ' ' ' C' . . . -97.09 19.64 12.59 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.227 0.537 . . . . 0.0 110.905 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 31.5 m -137.5 8.24 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.946 178.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . 0.495 ' O ' ' N ' ' B' ' 399' ' ' ASN . 1.2 m-20 164.91 62.47 0.0 OUTLIER Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 114.82 -1.082 . . . . 0.0 108.929 -179.289 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.535 ' HB2' ' O ' ' B' ' 418' ' ' ARG . 47.2 Cg_exo -34.04 -25.78 0.03 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 123.882 3.055 . . . . 0.0 113.943 -179.079 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.527 ' C ' ' O ' ' B' ' 398' ' ' PRO . 23.0 m120 -16.19 122.04 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 179.645 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 400' ' ' SER . . . . . 0.418 ' O ' HG23 ' B' ' 416' ' ' VAL . 0.9 OUTLIER -143.61 151.72 40.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.014 0.435 . . . . 0.0 111.303 -179.887 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.563 HG13 ' N ' ' B' ' 402' ' ' VAL . 0.7 OUTLIER -116.8 144.95 23.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.188 -179.591 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.563 ' N ' HG13 ' B' ' 401' ' ' ILE . 0.2 OUTLIER -110.25 150.22 12.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.294 -179.714 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.465 ' O ' ' HA ' ' B' ' 387' ' ' TYR . 0.1 OUTLIER -109.43 103.7 12.65 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-O 120.922 0.392 . . . . 0.0 109.965 178.967 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.47 ' SG ' ' O ' ' B' ' 413' ' ' GLY . 0.0 OUTLIER -81.4 91.2 6.25 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 179.296 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.563 ' CG ' ' O ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -133.97 152.27 51.79 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.202 -179.046 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.548 ' N ' ' HG2' ' B' ' 405' ' ' ARG . 0.9 OUTLIER -126.41 -174.5 1.08 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.507 0 CA-C-O 120.852 0.358 . . . . 0.0 111.202 -179.735 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 57.33 -94.4 0.04 OUTLIER Glycine 0 C--N 1.335 0.495 0 C-N-CA 120.791 -0.719 . . . . 0.0 111.872 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -164.45 26.51 0.07 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.019 0.438 . . . . 0.0 109.843 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 168.35 -16.48 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.526 -0.845 . . . . 0.0 113.146 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.563 ' O ' ' CG ' ' B' ' 405' ' ' ARG . 56.5 m -70.17 133.6 47.26 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 179.137 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . 0.551 ' O ' ' HB2' ' B' ' 412' ' ' LEU . 39.2 t -85.04 -115.15 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 C-N-CA 120.22 -0.592 . . . . 0.0 112.012 -178.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.551 ' HB2' ' O ' ' B' ' 411' ' ' VAL . 0.0 OUTLIER 138.24 -45.85 0.01 OUTLIER 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 -178.357 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . 0.488 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 173.38 -176.45 46.04 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 114.97 -1.014 . . . . 0.0 112.564 179.442 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.516 ' O ' ' ND2' ' B' ' 430' ' ' ASN . 0.2 OUTLIER -144.04 155.26 43.92 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.749 -0.226 . . . . 0.0 110.731 -179.719 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.466 ' CA ' ' HG3' ' B' ' 426' ' ' ARG . . . -146.18 140.96 9.19 Favored Glycine 0 C--O 1.226 -0.365 0 C-N-CA 120.063 -1.065 . . . . 0.0 112.853 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . 0.418 HG23 ' O ' ' B' ' 400' ' ' SER . 9.4 p -130.94 152.35 37.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.55 0.214 . . . . 0.0 110.474 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.544 ' HA3' ' CD1' ' B' ' 422' ' ' ILE . . . -164.45 155.29 26.6 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.589 -0.815 . . . . 0.0 112.48 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.535 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 1.5 ptm180 -64.2 -44.05 93.15 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.514 ' O ' HG13 ' B' ' 420' ' ' ILE . 0.6 OUTLIER -102.4 31.58 3.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.584 0.23 . . . . 0.0 110.412 179.304 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.592 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 54.28 -45.39 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 N-CA-C 114.676 1.361 . . . . 0.0 114.676 178.752 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.635 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -44.41 -57.24 3.66 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.635 ' N ' ' HD3' ' B' ' 421' ' ' LYS . 0.1 OUTLIER -47.87 -24.27 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.328 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.592 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -79.62 -48.46 13.71 Favored 'General case' 0 N--CA 1.439 -1.017 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 177.05 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -59.17 -50.33 68.9 Favored Glycine 0 N--CA 1.449 -0.477 0 N-CA-C 110.165 -1.174 . . . . 0.0 110.165 178.116 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . 0.51 ' CD1' ' HG2' ' B' ' 421' ' ' LYS . 1.2 mp -59.47 -66.82 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 177.457 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.58 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 10.4 tpt180 -38.07 -31.87 0.06 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.091 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.493 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -62.92 -62.39 1.75 Allowed 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.509 178.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.571 ' CB ' ' CB ' ' B' ' 370' ' ' ALA . . . -53.49 -50.26 65.74 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.59 ' O ' ' CD2' ' B' ' 432' ' ' LEU . 0.6 OUTLIER -56.03 -18.87 10.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.76 179.235 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.516 ' ND2' ' O ' ' B' ' 414' ' ' THR . 0.8 OUTLIER -81.34 -38.72 26.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.57 -0.287 . . . . 0.0 110.808 179.644 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.465 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -72.91 -33.42 65.98 Favored 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -178.246 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.592 ' C ' ' CD2' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -81.76 8.84 9.07 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.887 0.375 . . . . 0.0 111.527 -179.443 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . 0.538 ' CG ' ' O ' ' B' ' 429' ' ' GLU . 1.3 mtm180 -85.6 -3.91 59.01 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.939 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -115.25 79.55 1.3 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.386 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.542 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -48.0 -54.27 13.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.719 0.295 . . . . 0.0 111.071 -179.799 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.542 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 13.7 mtpp -55.2 -40.9 71.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.84 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.471 ' O ' ' HB3' ' B' ' 440' ' ' PHE . 17.5 tmm? -69.48 -52.97 21.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.993 0.425 . . . . 0.0 110.139 179.282 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.471 HD22 ' OE1' ' B' ' 373' ' ' GLN . 74.3 mt -50.73 -61.9 1.92 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.544 0.688 . . . . 0.0 110.329 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -49.43 -48.16 47.57 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.922 -1.035 . . . . 0.0 109.543 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.515 ' CD1' ' C ' ' B' ' 440' ' ' PHE . 0.1 OUTLIER -43.75 -42.67 5.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.484 179.743 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.603 ' CE2' ' HB2' ' B' ' 383' ' ' LEU . 36.8 m-85 -69.88 -36.74 75.69 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.094 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -51.34 -60.73 2.8 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 178.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . 0.424 ' C ' ' CD ' ' B' ' 443' ' ' LYS . 0.0 OUTLIER -48.08 -43.21 30.42 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.064 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.518 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -55.38 -55.83 27.07 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.262 178.954 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.577 ' HD2' ' CD2' ' B' ' 380' ' ' TYR . 0.2 OUTLIER -44.39 -36.98 3.1 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.347 179.582 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -81.43 -36.37 29.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.642 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . 0.481 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -64.68 -67.56 0.43 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.238 -179.663 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.512 HG12 ' O ' ' B' ' 445' ' ' ARG . 0.1 OUTLIER 28.34 89.01 0.08 OUTLIER Pre-proline 0 N--CA 1.464 0.245 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.135 179.556 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' B' ' 448' ' ' ILE . 2.6 Cg_endo -49.82 -19.76 4.04 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 122.844 2.363 . . . . 0.0 112.592 -179.246 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.09 -66.81 0.46 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.519 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -122.07 -171.02 2.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.94 0.4 . . . . 0.0 111.562 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 45.69 33.04 1.34 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.111 -179.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 5.2 p . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.233 -0.889 . . . . 0.0 111.012 179.808 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.376 0 O4'-C1'-N19 111.3 3.1 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.442 2.371 0 O4'-C1'-N19 111.278 3.078 . 0.375 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.644 " O2'" " C5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.692 0 C3'-C2'-C1' 105.078 3.976 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.644 " C5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.133 0 O4'-C1'-N19 111.393 3.193 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.487 " O4'" ' HB3' ' B' ' 398' ' ' PRO . . . . . . . . 0 O4'--C1' 1.439 2.119 0 O4'-C1'-N19 111.104 2.904 . 0.062 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.444 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.345 0 O4'-C1'-N19 111.107 2.907 . 0.127 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.809 ' H6 ' " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.922 0 O4'-C1'-N19 111.159 2.959 . 0.278 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.666 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.185 0 O4'-C1'-N19 111.222 3.022 . 0.334 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.666 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.439 0 O4'-C1'-N19 111.169 2.969 . 0.094 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.8 ' H6 ' " O5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.437 1.897 0 C5'-C4'-C3' 110.968 -3.021 . 0.032 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.636 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.39 0 C3'-C2'-C1' 104.154 2.949 . 0.02 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.694 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 P--O5' 1.612 1.903 0 O4'-C1'-N19 111.127 2.927 . 0.012 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.694 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.698 0 C3'-C2'-C1' 104.653 3.503 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.643 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.719 0 C3'-C2'-C1' 104.368 3.187 . 0.015 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.67 " O2'" " H5'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.431 -1.827 0 C5'-C4'-C3' 111.091 -2.939 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.67 " H5'" " O2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.431 -1.863 0 C5'-C4'-C3' 110.623 -3.251 OUTLIER-EPSILON 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.642 ' OP2' " H1'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 P--O5' 1.613 1.99 0 C5'-C4'-C3' 110.859 -3.094 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.697 " O3'" ' H8 ' ' A' ' 19' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.281 0 O4'-C1'-N19 111.475 3.275 OUTLIER-EPSILON 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.697 ' H8 ' " O3'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.537 0 P-O3'-C3' 123.445 3.121 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.687 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.677 0 C5'-C4'-C3' 111.078 -2.948 . 0.202 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.592 " O2'" " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.54 0 C3'-C2'-C1' 104.414 3.238 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.857 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.974 0 C5'-C4'-C3' 111.196 -2.87 . 0.026 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.677 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.438 0 O4'-C1'-N19 111.73 3.53 . 0.029 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.696 ' H6 ' " O5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 P--O5' 1.616 2.343 0 O4'-C1'-N19 110.784 2.584 . 0.087 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.503 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.254 0 O4'-C1'-N19 111.159 2.959 . 0.38 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.575 " O2'" " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.481 0 O4'-C1'-N19 111.179 2.979 . 0.155 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.687 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.024 0 C5'-C4'-C3' 111.185 -2.876 . 0.082 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.687 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.411 0 C3'-C2'-C1' 104.324 3.138 . 0.046 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.594 " O5'" " O2'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.443 2.405 0 O4'-C1'-N19 111.27 3.07 . 0.163 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 0.991 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.259 0 O4'-C1'-N19 111.311 3.111 . 0.044 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 0.991 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.413 0 O4'-C1'-N19 111.306 3.106 . 0.14 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . 0.603 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.57 0 C5'-C4'-C3' 111.058 -2.961 . 0.084 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.183 0 N-CA-C 112.556 -0.218 . . . . 0.0 112.556 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.68 54.63 0.31 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.755 0.312 . . . . 0.0 110.945 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . 0.504 ' O ' ' HB2' ' B' ' 369' ' ' ASN . 3.7 tp -75.8 0.56 17.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.54 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.546 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.1 OUTLIER -36.7 -77.11 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.917 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.548 ' CE ' ' N ' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -36.05 -41.28 0.24 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.988 178.994 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . 0.548 ' N ' ' CE ' ' B' ' 368' ' ' MET . 1.7 m-80 -61.8 -44.44 96.85 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.409 179.181 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.575 ' O ' ' N ' ' B' ' 373' ' ' GLN . . . -56.89 -68.46 0.22 Allowed 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.632 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.487 ' CE ' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -34.56 -47.93 0.34 Allowed 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.029 0.442 . . . . 0.0 110.35 -179.919 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.591 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.0 OUTLIER -56.57 -39.78 74.07 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.008 179.654 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.575 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.8 OUTLIER -63.62 -60.29 3.51 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.581 0.705 . . . . 0.0 110.751 179.31 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.518 HD13 ' CB ' ' B' ' 428' ' ' ALA . 0.2 OUTLIER -49.19 -72.47 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.114 -0.948 . . . . 0.0 113.428 -178.424 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . 0.475 ' HB2' " C5'" ' A' ' 20' ' ' ' A' . 3.8 m-85 -89.01 -2.99 58.84 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -176.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.591 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -119.04 5.73 11.32 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 119.915 -0.714 . . . . 0.0 111.415 179.811 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.523 ' HB3' ' O ' ' B' ' 373' ' ' GLN . 9.9 tp -144.11 -32.91 0.42 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.493 179.215 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.527 ' CG1' ' OE1' ' B' ' 373' ' ' GLN . 3.8 mm -134.58 37.15 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 120.836 0.35 . . . . 0.0 111.378 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . . . . . . . . . . . -120.75 93.02 0.52 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.623 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.591 ' CZ ' ' HG ' ' B' ' 383' ' ' LEU . 0.1 OUTLIER -126.93 -98.58 0.39 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.519 0.199 . . . . 0.0 110.985 179.633 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -155.58 -41.42 0.08 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.737 0.303 . . . . 0.0 111.426 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 382' ' ' SER . . . . . 0.46 ' OG ' HG22 ' B' ' 448' ' ' ILE . 0.2 OUTLIER -56.26 -51.1 69.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.912 0.387 . . . . 0.0 110.645 -180.0 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.591 ' HG ' ' CZ ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -92.13 37.43 0.98 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.873 179.843 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . 0.495 ' O ' ' CG ' ' B' ' 384' ' ' ARG . 2.0 ptm180 -26.21 97.7 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.921 -179.632 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.55 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 0.3 OUTLIER -59.89 163.04 4.88 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.955 179.374 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . 0.488 ' CB ' ' O ' ' B' ' 405' ' ' ARG . 0.0 OUTLIER -160.27 83.71 0.71 Allowed 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -179.188 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.561 ' CE2' ' SG ' ' B' ' 404' ' ' CYS . 60.4 m-85 -87.77 114.91 24.83 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 177.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -123.9 115.48 45.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.494 -0.483 . . . . 0.0 112.302 -179.372 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 3.9 m -70.37 128.86 37.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.543 179.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.54 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 19.9 m -132.71 159.89 42.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.6 -179.385 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.54 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 92.68 36.85 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.771 179.743 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.51 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER 0.94 117.82 0.0 OUTLIER Pre-proline 0 N--CA 1.472 0.634 0 O-C-N 124.038 0.836 . . . . 0.0 112.704 179.596 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.527 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 26.4 Cg_exo -60.37 163.76 14.3 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.669 2.246 . . . . 0.0 113.249 -179.688 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 394' ' ' THR . . . . . 0.461 ' O ' ' HD3' ' B' ' 398' ' ' PRO . 18.2 p -135.43 172.42 13.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.055 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . 0.413 ' CB ' ' O2 ' ' A' ' 29' ' ' ' U' . . . -98.05 18.36 16.24 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 121.174 0.512 . . . . 0.0 110.472 179.642 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . 0.404 HG23 ' OG1' ' B' ' 394' ' ' THR . 11.4 m -125.47 -0.85 5.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.967 178.414 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . 0.528 ' O ' ' N ' ' B' ' 399' ' ' ASN . 11.6 m-20 170.61 54.47 0.01 OUTLIER Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 114.625 -1.17 . . . . 0.0 108.599 -179.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.527 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 76.8 Cg_exo -29.56 -32.36 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 124.089 3.193 . . . . 0.0 113.517 -178.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.541 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 6.5 p30 -25.45 142.06 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.863 -178.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -140.79 158.07 44.49 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.643 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.582 ' CD1' ' CG2' ' B' ' 416' ' ' VAL . 0.2 OUTLIER -110.48 144.49 18.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.432 -0.803 . . . . 0.0 111.303 -179.399 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.564 ' N ' HG13 ' B' ' 401' ' ' ILE . 0.3 OUTLIER -109.7 146.21 15.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.777 -179.202 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -111.79 95.95 5.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.073 179.093 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.561 ' SG ' ' CE2' ' B' ' 387' ' ' TYR . 4.6 t -75.89 87.1 2.86 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.347 -0.842 . . . . 0.0 108.873 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.55 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -133.17 152.83 51.93 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.109 -179.205 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.55 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.9 OUTLIER -145.94 151.27 14.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.714 -179.103 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 67.79 -103.91 1.06 Allowed Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.736 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -149.68 2.76 0.54 Allowed 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -166.37 22.61 0.12 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 119.896 -1.145 . . . . 0.0 113.18 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.55 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 0.2 OUTLIER -116.31 97.61 6.13 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 117.116 0.458 . . . . 0.0 110.926 179.536 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . 0.544 ' O ' ' N ' ' B' ' 413' ' ' GLY . 56.1 t -106.36 64.92 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.705 179.18 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.469 ' C ' ' O ' ' B' ' 411' ' ' VAL . 0.1 OUTLIER -30.66 -35.33 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 120.676 0.274 . . . . 0.0 110.907 -179.56 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . 0.544 ' N ' ' O ' ' B' ' 411' ' ' VAL . . . 165.97 -157.38 29.82 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 119.721 -1.228 . . . . 0.0 113.494 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.5 ' O ' ' ND2' ' B' ' 430' ' ' ASN . 1.1 t -153.89 174.05 15.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.27 -0.465 . . . . 0.0 111.803 -178.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.481 ' HA2' ' HD2' ' B' ' 426' ' ' ARG . . . -158.02 139.76 6.56 Favored Glycine 0 C--O 1.222 -0.641 0 C-N-CA 120.298 -0.953 . . . . 0.0 113.123 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . 0.582 ' CG2' ' CD1' ' B' ' 401' ' ' ILE . 41.5 t -126.13 149.92 31.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 179.118 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.541 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -163.0 162.16 34.46 Favored Glycine 0 C--O 1.225 -0.407 0 C-N-CA 120.126 -1.035 . . . . 0.0 112.465 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.539 ' N ' HD12 ' B' ' 422' ' ' ILE . 1.6 ptt180 -76.95 -41.87 41.45 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.707 0.254 . . . . 0.0 111.684 -179.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.481 ' O ' HG13 ' B' ' 420' ' ' ILE . 0.2 OUTLIER -101.65 27.59 6.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.034 0.445 . . . . 0.0 109.824 179.009 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.587 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 55.75 -44.76 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 178.485 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.657 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.2 OUTLIER -43.49 -58.92 2.37 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 179.565 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.657 ' N ' ' HD3' ' B' ' 421' ' ' LYS . 0.1 OUTLIER -45.82 -26.23 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.667 178.658 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.587 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -77.51 -47.66 19.0 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 177.224 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -63.6 -55.67 23.84 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.732 178.779 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . 0.514 ' CG1' ' HB3' ' B' ' 367' ' ' ASP . 0.9 OUTLIER -58.25 -71.71 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 178.621 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.546 ' HB3' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -44.16 -26.19 0.29 Allowed 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.699 -178.743 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.567 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -61.62 -54.48 42.37 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 176.809 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.518 ' CB ' HD13 ' B' ' 374' ' ' LEU . . . -53.47 -49.49 67.34 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 107.964 -1.125 . . . . 0.0 107.964 177.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.558 ' O ' ' CD2' ' B' ' 432' ' ' LEU . 49.7 mt-10 -53.99 -21.97 9.38 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.365 178.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.567 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.7 OUTLIER -75.73 -37.28 59.54 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 178.341 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.44 ' O ' ' HE1' ' B' ' 437' ' ' MET . . . -68.49 -48.47 64.36 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.299 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.558 ' CD2' ' O ' ' B' ' 429' ' ' GLU . 0.1 OUTLIER -76.91 1.31 17.99 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.117 0.484 . . . . 0.0 111.343 -179.953 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.82 -14.26 61.92 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.883 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . 0.482 ' HB2' ' HB3' ' B' ' 437' ' ' MET . 5.6 m-20 -120.76 86.64 2.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.927 -178.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.583 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 6.1 ptpp? -52.61 -52.62 54.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.983 0.421 . . . . 0.0 110.213 179.275 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.583 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 5.4 mtpp -50.63 -36.41 35.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.546 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.482 ' HB3' ' HB2' ' B' ' 434' ' ' ASP . 1.1 ttp -80.11 -44.76 19.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.724 179.008 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.541 ' CD1' ' HA ' ' B' ' 432' ' ' LEU . 87.2 mt -53.08 -63.01 1.28 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.669 0.747 . . . . 0.0 109.545 178.709 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . 0.405 ' O ' ' C ' ' B' ' 440' ' ' PHE . 9.1 t70 -55.57 -44.51 76.93 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.029 -0.987 . . . . 0.0 108.973 178.507 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.469 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.1 OUTLIER -41.6 -42.26 2.41 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.187 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.54 ' CE1' ' HB2' ' B' ' 383' ' ' LEU . 46.3 m-85 -68.11 -46.45 70.87 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.232 -0.894 . . . . 0.0 110.675 179.348 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -42.82 -60.82 1.45 Allowed 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 178.701 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.67 -44.21 57.63 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.84 178.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.497 ' O ' HG12 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -55.11 -55.38 31.7 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.06 179.278 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.566 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.1 OUTLIER -50.49 -41.56 53.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.559 -179.89 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -65.72 -46.09 80.25 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.092 0.472 . . . . 0.0 110.263 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . 0.479 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -74.2 -76.61 0.13 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.76 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.546 ' CD1' ' O ' ' B' ' 445' ' ' ARG . 0.5 OUTLIER 23.94 87.44 0.08 OUTLIER Pre-proline 0 N--CA 1.463 0.219 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.904 -179.144 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . 0.422 ' O ' ' O ' ' B' ' 448' ' ' ILE . 54.4 Cg_exo -53.2 -161.91 0.0 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.158 0 C-N-CA 122.789 2.326 . . . . 0.0 112.181 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.59 -71.13 0.08 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.777 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 24.4 p -177.35 52.03 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.591 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -118.74 122.96 43.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.792 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 3.4 p . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.333 -0.842 . . . . 0.0 111.047 -179.926 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.759 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.434 1.684 0 O4'-C1'-N19 111.11 2.91 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.759 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.371 0 O4'-C1'-N19 111.245 3.045 . 0.337 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.608 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.441 0 O4'-C1'-N19 111.131 2.931 . 0.243 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.499 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.187 0 O4'-C1'-N19 111.449 3.249 . 0.135 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.87 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 P--O5' 1.613 1.998 0 C5'-C4'-C3' 111.149 -2.9 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.798 " O2'" " H5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.415 0 O4'-C1'-N19 111.03 2.83 . 0.075 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.798 " H5'" " O2'" ' A' ' 6' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.94 0 O4'-C1'-N19 111.493 3.293 . 0.247 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.486 ' C4 ' ' N7 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.443 2.454 0 O4'-C1'-N19 111.089 2.889 . 0.233 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.537 HO2' " C5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.504 0 C5'-C4'-C3' 111.175 -2.883 . 0.104 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.766 ' H6 ' " O5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.435 1.722 0 C5'-C4'-C3' 110.896 -3.069 . 0.053 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.66 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.434 0 O4'-C1'-N19 111.472 3.272 . 0.018 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.722 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.095 0 O4'-C1'-N19 111.254 3.054 . 0.032 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.722 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.412 0 C3'-C2'-C1' 104.609 3.455 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.648 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.402 0 C5'-C4'-C3' 111.018 -2.988 . 0.026 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.728 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.43 -1.897 0 C5'-C4'-C3' 110.879 -3.081 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.728 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.431 -1.874 0 O4'-C1'-N19 111.489 3.289 . 0.18 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.519 " O2'" ' P ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.561 0 C5'-C4'-C3' 110.962 -3.025 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.559 " O2'" ' HB2' ' B' ' 376' ' ' SER . . . . . . . . 0 P--O5' 1.61 1.715 0 O4'-C1'-N19 110.991 2.791 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.425 " O2'" " O4'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.037 0 C5'-C4'-C3' 111.193 -2.871 . 0.225 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.779 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.436 1.822 0 C5'-C4'-C3' 111.105 -2.93 . 0.334 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.779 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.524 0 C3'-C2'-C1' 104.167 2.963 . 0.037 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.915 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.614 2.05 0 O4'-C1'-N19 110.933 2.733 . 0.049 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.69 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.217 0 O4'-C1'-N19 111.665 3.465 . 0.045 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.776 ' H6 ' " O5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.225 0 O4'-C1'-N19 110.85 2.65 . 0.086 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.448 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.261 0 O4'-C1'-N19 111.138 2.938 . 0.351 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.609 " O2'" " C5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.315 0 O4'-C1'-N19 111.301 3.101 . 0.077 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.938 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 P--O5' 1.613 1.999 0 C5'-C4'-C3' 111.35 -2.767 . 0.139 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.938 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.286 0 C3'-C2'-C1' 104.299 3.11 . 0.027 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.944 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.28 0 O4'-C1'-N19 111.217 3.017 . 0.175 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 0.944 " H5'" " O2'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.297 0 O4'-C1'-N19 111.643 3.443 . 0.067 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 0.884 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.386 0 O4'-C1'-N19 111.406 3.206 . 0.155 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . 0.682 " H5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.277 0 O4'-C1'-N19 111.105 2.905 . 0.392 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.178 0 N-CA-C 112.444 -0.263 . . . . 0.0 112.444 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 15.2 m -134.31 41.14 2.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.876 0.369 . . . . 0.0 110.815 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -45.23 119.98 2.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.208 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.497 ' OD1' ' N ' ' B' ' 367' ' ' ASP . 0.1 OUTLIER -58.16 -64.96 0.73 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.941 179.363 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.55 ' SD ' " O2'" ' A' ' 15' ' ' ' A' . 1.4 ttp -33.74 -48.21 0.27 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.912 179.75 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 32.2 m-20 -61.8 -45.48 93.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.811 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.582 ' O ' ' N ' ' B' ' 373' ' ' GLN . . . -59.69 -69.67 0.2 Allowed 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.565 ' HG2' HO2' ' A' ' 20' ' ' ' A' . 0.0 OUTLIER -32.92 -52.74 0.34 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.977 0.418 . . . . 0.0 110.699 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.489 ' NH1' ' C2 ' ' A' ' 18' ' ' ' A' . 0.0 OUTLIER -58.4 -37.44 75.31 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.074 -179.966 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.582 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -64.09 -65.91 0.61 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.598 0.713 . . . . 0.0 110.904 179.558 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.508 HD23 ' O ' ' B' ' 428' ' ' ALA . 4.3 mm? -48.14 -68.23 0.2 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.208 -0.906 . . . . 0.0 112.621 -179.217 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . 0.518 ' CE2' ' OP1' ' A' ' 20' ' ' ' A' . 0.2 OUTLIER -79.4 -42.66 25.01 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 -176.785 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.559 ' HB2' " O2'" ' A' ' 18' ' ' ' A' . 0.0 OUTLIER -91.54 10.46 27.83 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -177.619 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.561 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.3 OUTLIER -140.67 -38.18 0.44 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.66 0.266 . . . . 0.0 111.213 179.264 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.44 HD11 ' O ' ' B' ' 377' ' ' LEU . 5.7 mm -121.73 34.64 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 121.081 0.467 . . . . 0.0 110.966 179.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . . . . . . . . . . . -149.31 69.75 0.33 Allowed Glycine 0 N--CA 1.453 -0.232 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.908 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.594 ' CG ' ' HD3' ' B' ' 445' ' ' ARG . 2.2 p90 -61.98 -59.87 4.46 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 -179.035 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . 170.29 -29.64 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.875 0.369 . . . . 0.0 111.59 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.39 40.9 1.86 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.321 179.6 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . . . . . . . . . 6.7 tt -115.35 -40.51 3.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.827 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 65.3 65.97 0.55 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.198 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.468 HD13 ' CG1' ' B' ' 406' ' ' VAL . 0.7 OUTLIER -48.65 155.84 0.52 Allowed 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.482 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . 0.505 ' O ' ' O ' ' B' ' 405' ' ' ARG . 0.9 OUTLIER -153.3 98.17 2.24 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -178.681 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.702 ' HB2' ' HA ' ' B' ' 404' ' ' CYS . 0.1 OUTLIER -139.72 151.54 45.94 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.929 176.553 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -144.51 163.65 13.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.749 -177.079 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 3.4 m -102.78 129.95 49.59 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.077 0.465 . . . . 0.0 110.898 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.56 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 5.4 m -134.92 162.42 38.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.01 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.56 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 98.92 28.55 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.206 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.526 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.1 OUTLIER 0.37 117.52 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.679 0 O-C-N 124.119 0.887 . . . . 0.0 112.247 179.851 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.504 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 18.7 Cg_exo -62.72 158.35 42.68 Favored 'Trans proline' 0 N--CA 1.463 -0.304 0 C-N-CA 122.477 2.118 . . . . 0.0 113.401 -179.229 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 394' ' ' THR . . . . . 0.496 ' O ' ' HD3' ' B' ' 398' ' ' PRO . 15.9 p -137.96 167.53 21.57 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.5 -1.227 . . . . 0.0 111.096 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . 0.553 ' O ' " O2'" ' A' ' 30' ' ' ' C' . . . -92.29 17.19 10.12 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-O 121.262 0.553 . . . . 0.0 110.22 179.165 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . 0.407 ' O ' ' CG ' ' B' ' 397' ' ' ASP . 17.4 m -125.67 -6.52 5.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.166 -0.924 . . . . 0.0 109.944 177.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . 0.465 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 28.9 m-20 179.45 54.46 0.05 OUTLIER Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 114.623 -1.172 . . . . 0.0 108.749 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.504 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 57.6 Cg_exo -31.76 -38.38 0.07 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 123.746 2.964 . . . . 0.0 113.643 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.593 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -28.31 139.91 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.493 0.663 . . . . 0.0 112.652 -177.775 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 12.0 t -141.09 148.79 40.7 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.964 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.462 ' HA ' ' HA ' ' B' ' 416' ' ' VAL . 12.1 tt -107.57 156.22 8.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 121.133 0.492 . . . . 0.0 111.875 -179.508 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.476 HG21 ' O ' ' B' ' 415' ' ' GLY . 0.2 OUTLIER -127.99 141.1 47.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.652 -179.381 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.55 ' O ' ' HB2' ' B' ' 387' ' ' TYR . 0.7 OUTLIER -100.76 94.1 5.9 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.027 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.702 ' HA ' ' HB2' ' B' ' 387' ' ' TYR . 1.1 p -82.26 99.08 9.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.861 0.839 . . . . 0.0 110.391 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.532 ' CB ' ' O ' ' B' ' 410' ' ' THR . 0.2 OUTLIER -132.48 164.63 26.15 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.704 -178.71 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.514 ' N ' ' HG3' ' B' ' 405' ' ' ARG . 1.2 m -132.59 128.5 57.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.953 0.406 . . . . 0.0 111.96 -178.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . 0.472 ' O ' ' HB3' ' B' ' 408' ' ' ASP . . . 79.64 8.49 87.68 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.921 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . 0.472 ' HB3' ' O ' ' B' ' 407' ' ' GLY . 9.2 t70 66.88 11.68 8.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.87 0.367 . . . . 0.0 110.632 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -125.97 -37.29 0.51 Allowed Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.492 -0.861 . . . . 0.0 112.99 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.532 ' O ' ' CB ' ' B' ' 405' ' ' ARG . 95.0 m -103.13 136.77 42.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.959 0.409 . . . . 0.0 112.035 -179.097 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . 0.494 ' HA ' ' HB2' ' B' ' 405' ' ' ARG . 79.1 t -120.15 80.25 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.726 179.382 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.553 ' CB ' ' HA ' ' B' ' 431' ' ' ALA . 0.1 OUTLIER -41.19 -38.66 1.14 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.889 179.75 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . 0.468 ' O ' ' SG ' ' B' ' 404' ' ' CYS . . . 172.34 -169.73 42.82 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.374 -0.917 . . . . 0.0 112.916 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.458 ' OG1' ' O ' ' B' ' 402' ' ' VAL . 2.2 t -145.21 138.09 26.25 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.754 0.312 . . . . 0.0 111.207 -178.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.553 ' CA ' ' HG3' ' B' ' 426' ' ' ARG . . . -117.87 133.43 10.45 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.239 -0.982 . . . . 0.0 113.761 -179.013 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . 0.462 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 11.7 p -117.38 153.96 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 178.555 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.593 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -161.98 157.64 29.46 Favored Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.18 -1.01 . . . . 0.0 111.67 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.527 ' HA ' ' CB ' ' B' ' 399' ' ' ASN . 1.9 ptm180 -73.67 -40.29 63.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.918 0.39 . . . . 0.0 111.608 -179.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.559 ' O ' HG13 ' B' ' 420' ' ' ILE . 8.2 t30 -100.91 27.17 6.2 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.65 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.59 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 54.91 -47.76 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 179.82 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.503 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -43.62 -59.02 2.37 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.116 -0.633 . . . . 0.0 109.377 -179.714 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.616 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.0 OUTLIER -44.39 -22.2 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.325 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.844 177.906 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.59 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -80.95 -49.79 10.54 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 177.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . 0.446 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -56.36 -48.65 74.02 Favored Glycine 0 C--N 1.337 0.631 0 C-N-CA 119.586 -1.292 . . . . 0.0 110.3 178.344 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . 0.551 ' O ' ' N ' ' B' ' 428' ' ' ALA . 1.2 mp -65.4 -64.75 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 177.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.616 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 14.8 tpt180 -39.08 -31.27 0.07 Allowed 'General case' 0 C--O 1.225 -0.196 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.586 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -65.25 -52.32 55.23 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 178.053 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.551 ' N ' ' O ' ' B' ' 425' ' ' ILE . . . -55.91 -51.83 66.23 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 177.516 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.517 ' O ' HD23 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -57.93 -31.65 67.02 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.862 179.251 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.586 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 19.0 m120 -57.43 -41.21 80.01 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.553 ' HA ' ' CB ' ' B' ' 412' ' ' LEU . . . -69.03 -45.14 71.23 Favored 'General case' 0 CA--C 1.527 0.084 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.686 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.53 ' HA ' ' CD1' ' B' ' 438' ' ' LEU . 0.0 OUTLIER -77.67 -9.84 59.19 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.841 0.353 . . . . 0.0 111.445 -179.382 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . 0.492 ' HG2' ' HA ' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -80.08 16.82 1.12 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.672 -179.504 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . 0.462 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 90.3 m-20 -140.27 79.85 1.73 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.656 0.265 . . . . 0.0 110.337 179.103 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.589 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -46.69 -58.5 3.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.801 -179.551 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.589 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 1.6 mmpp? -49.65 -37.14 27.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.89 0.376 . . . . 0.0 110.451 -179.45 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.481 ' O ' ' HB3' ' B' ' 440' ' ' PHE . 0.5 OUTLIER -73.84 -51.46 16.21 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.498 179.284 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.53 ' CD1' ' HA ' ' B' ' 432' ' ' LEU . 90.0 mt -52.36 -61.7 2.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.283 0.563 . . . . 0.0 110.691 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . 0.475 ' O ' ' N ' ' B' ' 442' ' ' ALA . 3.5 t70 -48.69 -51.13 30.15 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 178.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.481 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -40.13 -42.65 1.49 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.063 179.83 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.52 ' O ' ' N ' ' B' ' 444' ' ' GLN . 49.8 m-85 -67.72 -42.02 82.59 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.781 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . 0.516 ' O ' ' N ' ' B' ' 445' ' ' ARG . . . -43.04 -59.31 2.07 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 177.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.2 -42.91 41.69 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 177.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.527 ' O ' ' CG2' ' B' ' 448' ' ' ILE . 0.0 OUTLIER -73.39 3.59 5.78 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.906 179.017 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.594 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -99.23 -45.02 6.03 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.371 179.238 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -79.38 -34.8 41.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.728 179.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . 0.526 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -66.8 -66.79 0.51 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.792 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.538 ' CG1' ' O ' ' B' ' 445' ' ' ARG . 1.1 pt -8.03 81.99 0.03 OUTLIER Pre-proline 0 N--CA 1.465 0.317 0 O-C-N 123.934 0.771 . . . . 0.0 112.551 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . 0.439 ' O ' ' CB ' ' B' ' 450' ' ' ARG . 77.7 Cg_exo -37.77 -59.95 0.48 Allowed 'Trans proline' 0 N--CA 1.461 -0.44 0 C-N-CA 122.914 2.409 . . . . 0.0 112.453 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . 0.439 ' CB ' ' O ' ' B' ' 449' ' ' PRO . 0.0 OUTLIER 78.2 38.0 0.18 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.728 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 17.9 t 50.98 62.68 2.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.825 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -99.19 112.83 24.89 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.624 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.006 -179.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.791 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 C2'--O2' 1.433 1.507 0 C5'-C4'-C3' 111.03 -2.98 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.791 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.331 0 O4'-C1'-N19 111.251 3.051 . 0.133 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.545 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.278 0 O4'-C1'-N19 111.134 2.934 . 0.354 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.457 " H2'" ' C6 ' ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.133 0 O4'-C1'-N19 111.208 3.008 . 0.125 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.459 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.291 0 O4'-C1'-N19 111.467 3.267 . 0.144 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.642 " O2'" " C5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.479 0 C3'-C2'-C1' 104.241 3.045 . 0.072 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.642 " C5'" " O2'" ' A' ' 6' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.124 0 O4'-C1'-N19 111.324 3.124 . 0.104 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.408 ' C4 ' ' N7 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.443 2.39 0 O4'-C1'-N19 111.144 2.944 . 0.366 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.444 " H2'" ' C6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.399 0 O4'-C1'-N19 111.148 2.948 . 0.099 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.653 ' H6 ' " O5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 1.965 0 O4'-C1'-N19 111.23 3.03 . 0.163 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.641 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.427 0 O4'-C1'-N19 111.275 3.075 . 0.046 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.835 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.436 1.858 0 C5'-C4'-C3' 110.994 -3.004 . 0.017 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.835 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.608 0 C3'-C2'-C1' 104.795 3.661 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.708 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.263 0 C5'-C4'-C3' 111.143 -2.905 . 0.048 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.917 " O2'" " H5'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.139 0 C5'-C4'-C3' 110.836 -3.109 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.917 " H5'" " O2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.612 1.894 0 O4'-C1'-N19 111.361 3.161 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.949 " H1'" ' OP1' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.433 -1.639 0 C5'-C4'-C3' 110.863 -3.091 OUTLIER-EPSILON 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.949 ' OP1' " H1'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.001 0 C5'-C4'-C3' 111.108 -2.928 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.653 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -1.97 0 O4'-C1'-N19 111.229 3.029 . 0.038 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.846 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.436 1.828 0 C5'-C4'-C3' 110.998 -3.002 . 0.142 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.846 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.436 0 C5'-C4'-C3' 111.067 -2.955 . 0.033 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.804 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.16 0 O4'-C1'-N19 111.176 2.976 . 0.128 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.585 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.295 0 O4'-C1'-N19 111.76 3.56 . 0.105 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.796 ' H6 ' " O5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 P--O5' 1.615 2.151 0 C5'-C4'-C3' 111.612 -2.592 . 0.096 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.422 ' O6 ' ' O6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.187 0 O4'-C1'-N19 111.334 3.134 . 0.254 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.572 " O2'" " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.731 0 C5'-C4'-C3' 111.186 -2.876 . 0.081 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.931 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.19 0 O4'-C1'-N19 111.108 2.908 . 0.129 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.931 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.262 0 C3'-C2'-C1' 104.253 3.059 . 0.132 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.637 " C5'" " O2'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.274 0 O4'-C1'-N19 111.207 3.007 . 0.214 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 0.622 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.443 2.412 0 O4'-C1'-N19 111.351 3.151 . 0.111 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 0.818 " O2'" " H5'" ' A' ' 32' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.5 0 O4'-C1'-N19 111.224 3.024 . 0.636 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . 0.818 " H5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.595 0 C5'-C4'-C3' 111.148 -2.901 . 0.582 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.219 0 N-CA-C 112.638 -0.185 . . . . 0.0 112.638 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 6.9 m -71.26 86.53 0.8 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.814 0.34 . . . . 0.0 110.941 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -125.31 119.89 29.64 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.081 -179.861 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.461 ' OD2' HG13 ' B' ' 425' ' ' ILE . 3.9 t70 -59.58 -61.56 2.53 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.809 179.329 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.505 ' HA ' ' CD ' ' B' ' 371' ' ' LYS . 8.8 ttp -34.6 -50.47 0.45 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.611 179.477 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -61.92 -48.01 82.35 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.694 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.589 ' CB ' ' CB ' ' B' ' 428' ' ' ALA . . . -64.94 -72.5 0.15 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.743 0.306 . . . . 0.0 110.69 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.549 ' HE3' ' H22' ' A' ' 19' ' ' ' G' . 0.0 OUTLIER -34.86 -42.55 0.16 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.857 179.828 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.556 ' O ' ' CB ' ' B' ' 376' ' ' SER . 1.8 ttp-105 -66.64 -39.23 88.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.235 -179.792 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.561 ' HG3' ' CG ' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -62.49 -54.67 36.63 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.209 0.528 . . . . 0.0 110.415 179.54 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.463 HD23 ' N ' ' B' ' 374' ' ' LEU . 1.1 mm? -55.93 -68.53 0.2 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.267 -0.878 . . . . 0.0 113.048 -179.102 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . 0.582 ' CE2' ' OP1' ' A' ' 20' ' ' ' A' . 3.5 m-85 -74.91 -45.13 44.72 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -177.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.556 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -70.8 -54.25 12.33 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.319 -0.552 . . . . 0.0 111.386 -179.404 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.517 ' CB ' ' O ' ' B' ' 373' ' ' GLN . 0.0 OUTLIER -71.02 -43.59 67.61 Favored 'General case' 0 CA--C 1.509 -0.618 0 CA-C-O 121.196 0.522 . . . . 0.0 109.971 -178.856 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.469 ' O ' ' O ' ' B' ' 375' ' ' TYR . 2.4 mm -120.36 -138.5 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.926 0 CA-C-N 115.374 -0.83 . . . . 0.0 108.878 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.522 ' O ' ' O ' ' B' ' 380' ' ' TYR . . . 99.53 -22.37 40.91 Favored Glycine 0 C--N 1.321 -0.3 0 C-N-CA 120.943 -0.646 . . . . 0.0 112.089 -179.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.597 ' HB3' HD22 ' B' ' 383' ' ' LEU . 0.1 OUTLIER 34.92 -175.41 0.0 OUTLIER 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 178.867 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -121.16 -28.2 4.76 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 113.092 -1.867 . . . . 0.0 109.985 179.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -143.57 50.49 1.37 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.653 179.622 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.597 HD22 ' HB3' ' B' ' 380' ' ' TYR . 0.8 OUTLIER -116.4 -36.14 4.09 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 120.913 0.387 . . . . 0.0 110.421 178.857 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . 0.515 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 1.9 tpt85 74.71 78.76 0.11 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.718 179.173 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.51 ' HA ' ' HB ' ' B' ' 406' ' ' VAL . 9.7 tt -107.25 124.29 49.54 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 178.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . 0.421 ' O ' ' O ' ' B' ' 405' ' ' ARG . 26.4 p-80 -145.22 145.91 31.5 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 -178.185 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.577 ' CZ ' ' HB3' ' B' ' 404' ' ' CYS . 3.9 m-85 -106.05 147.74 28.55 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 114.56 -1.2 . . . . 0.0 111.066 178.319 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . 0.519 HG21 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -133.43 128.64 55.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.351 179.448 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.2 m -86.83 123.75 32.31 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.963 179.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.534 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 29.1 m -130.06 154.84 40.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.363 0.602 . . . . 0.0 112.222 -179.314 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.54 ' O ' ' C ' ' B' ' 392' ' ' LYS . 4.4 tptt 90.7 23.68 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.544 179.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.54 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.1 OUTLIER 1.71 108.37 0.01 OUTLIER Pre-proline 0 N--CA 1.468 0.439 0 O-C-N 123.966 0.792 . . . . 0.0 112.44 179.766 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.486 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 6.0 Cg_exo -45.55 160.41 0.16 Allowed 'Trans proline' 0 N--CA 1.462 -0.33 0 C-N-CA 122.856 2.37 . . . . 0.0 113.514 -179.174 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 31.8 p -127.2 169.76 13.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.53 179.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . 0.515 ' O ' " O2'" ' A' ' 30' ' ' ' C' . . . -96.19 20.21 10.65 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 121.24 0.543 . . . . 0.0 110.715 179.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 33.6 m -136.05 6.64 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.005 178.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . 0.455 ' O ' ' N ' ' B' ' 399' ' ' ASN . 0.2 OUTLIER 168.17 58.09 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 114.949 -1.023 . . . . 0.0 108.847 -179.38 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.486 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 3.3 Cg_exo -35.64 -27.3 0.05 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 124.062 3.175 . . . . 0.0 113.108 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.579 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 1.3 p-10 -29.28 120.43 0.14 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.619 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 400' ' ' SER . . . . . 0.448 ' OG ' ' HD3' ' B' ' 393' ' ' PRO . 48.9 m -130.71 158.17 40.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.906 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.535 HG13 ' N ' ' B' ' 402' ' ' VAL . 0.4 OUTLIER -115.14 144.89 21.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.991 -179.796 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.535 ' N ' HG13 ' B' ' 401' ' ' ILE . 0.2 OUTLIER -110.77 157.59 11.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.558 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.519 ' CB ' HG21 ' B' ' 388' ' ' VAL . 2.4 mm-40 -123.9 119.4 29.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.102 179.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.577 ' HB3' ' CZ ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -102.39 103.23 13.63 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.669 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.524 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.8 OUTLIER -142.68 170.44 15.7 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.125 -179.305 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.515 ' HB ' ' O ' ' B' ' 384' ' ' ARG . 1.0 OUTLIER -148.57 177.69 0.88 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.547 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.515 -179.03 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 58.2 -102.84 0.28 Allowed Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 115.153 -0.93 . . . . 0.0 112.577 179.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -158.13 21.16 0.25 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.751 0.31 . . . . 0.0 110.842 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 170.99 31.95 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.667 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.524 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 99.3 m -124.31 111.68 16.1 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 121.05 -0.26 . . . . 0.0 110.983 179.519 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . 0.466 HG11 ' OE1' ' B' ' 403' ' ' GLU . 58.2 t -103.61 107.43 22.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 178.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.548 ' HB3' ' HA ' ' B' ' 431' ' ' ALA . 0.0 OUTLIER -68.42 -26.11 65.37 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.633 -179.829 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . 0.464 ' O ' ' SG ' ' B' ' 404' ' ' CYS . . . 174.34 -177.22 46.61 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.874 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.443 ' O ' ' ND2' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -146.37 152.68 39.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.787 -0.206 . . . . 0.0 110.79 -179.832 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.442 ' O ' HG13 ' B' ' 401' ' ' ILE . . . -149.53 158.06 27.5 Favored Glycine 0 C--O 1.227 -0.302 0 C-N-CA 119.757 -1.211 . . . . 0.0 113.647 -179.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . 0.455 ' HB ' HD11 ' B' ' 401' ' ' ILE . 1.4 p -141.4 151.41 19.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.528 -0.336 . . . . 0.0 110.779 179.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.579 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -165.18 142.91 8.05 Favored Glycine 0 C--O 1.228 -0.265 0 C-N-CA 120.957 -0.639 . . . . 0.0 111.732 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.52 ' CG ' ' OD1' ' B' ' 419' ' ' ASN . 4.7 ptm180 -60.64 -43.77 97.18 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -179.059 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.545 ' O ' HG13 ' B' ' 420' ' ' ILE . 0.1 OUTLIER -100.19 34.35 2.37 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 178.893 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.61 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 51.09 -46.39 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 N-CA-C 114.746 1.387 . . . . 0.0 114.746 179.328 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.544 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -43.96 -58.61 2.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 118.784 0.72 . . . . 0.0 109.768 -179.71 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.601 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.0 OUTLIER -45.06 -19.84 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 177.261 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.61 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -88.0 -49.26 7.17 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 177.607 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . 0.464 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -58.8 -44.79 95.68 Favored Glycine 0 C--N 1.339 0.708 0 C-N-CA 119.914 -1.136 . . . . 0.0 110.775 178.538 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . 0.461 HG13 ' OD2' ' B' ' 367' ' ' ASP . 2.4 mp -67.25 -64.86 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 178.055 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.601 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -40.41 -26.56 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.816 179.039 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.429 ' N ' ' O ' ' B' ' 425' ' ' ILE . . . -73.91 -55.28 6.36 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.529 179.428 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.589 ' CB ' ' CB ' ' B' ' 370' ' ' ALA . . . -50.7 -50.57 54.82 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.028 0.442 . . . . 0.0 110.203 179.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.632 ' O ' HD23 ' B' ' 432' ' ' LEU . 0.6 OUTLIER -58.7 -66.15 0.54 Allowed 'General case' 0 C--O 1.218 -0.553 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 178.094 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.502 ' C ' ' O ' ' B' ' 429' ' ' GLU . 0.3 OUTLIER -24.83 -42.29 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.267 179.512 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.548 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -78.23 -39.12 41.31 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.286 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.632 HD23 ' O ' ' B' ' 429' ' ' GLU . 0.0 OUTLIER -78.75 8.42 5.44 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.146 0.498 . . . . 0.0 111.576 179.812 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.64 -5.25 58.8 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.516 -179.426 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . 0.448 ' OD2' ' HB2' ' B' ' 437' ' ' MET . 54.1 t0 -107.02 90.77 3.4 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.843 0.354 . . . . 0.0 111.283 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.551 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.2 OUTLIER -51.62 -53.3 39.93 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.019 179.94 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.551 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.2 OUTLIER -54.52 -43.66 72.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.973 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.528 ' CE ' ' HG ' ' B' ' 412' ' ' LEU . 16.6 tmm? -69.86 -55.4 9.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.852 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.527 ' CD2' ' HA ' ' B' ' 432' ' ' LEU . 69.7 mt -52.81 -62.79 1.42 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.276 0.56 . . . . 0.0 110.337 179.471 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . 0.431 ' O ' ' N ' ' B' ' 442' ' ' ALA . 14.1 t0 -50.53 -47.27 57.61 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.244 -0.889 . . . . 0.0 108.924 178.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.479 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.5 OUTLIER -44.12 -41.16 5.44 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.264 179.565 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.548 ' CE1' HD11 ' B' ' 383' ' ' LEU . 43.2 m-85 -74.2 -31.83 62.81 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.436 179.502 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . 0.431 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -59.32 -61.94 2.25 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.01 -42.58 63.14 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 178.4 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.459 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -54.48 -56.19 21.27 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.547 -0.752 . . . . 0.0 109.691 178.685 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.512 ' O ' ' CD1' ' B' ' 448' ' ' ILE . 0.0 OUTLIER -46.43 -38.21 8.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.96 179.649 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -77.29 -40.19 45.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.765 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . 0.522 ' O ' ' N ' ' B' ' 449' ' ' PRO . . . -62.27 -59.73 4.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.842 -179.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.516 ' CG2' ' OH ' ' B' ' 380' ' ' TYR . 0.5 OUTLIER -30.13 87.95 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.902 -179.881 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . 0.522 ' N ' ' O ' ' B' ' 447' ' ' ALA . 49.9 Cg_exo -60.06 132.64 45.61 Favored 'Trans proline' 0 CA--C 1.52 -0.206 0 C-N-CA 123.118 2.545 . . . . 0.0 112.633 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 41.28 -151.03 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.723 179.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 451' ' ' SER . . . . . 0.439 ' O ' ' HG3' ' B' ' 452' ' ' GLU . 0.0 OUTLIER -152.85 156.58 39.28 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.956 0.408 . . . . 0.0 111.315 179.955 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' B' ' 451' ' ' SER . 4.4 pt-20 36.96 68.27 0.28 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.873 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.175 -0.916 . . . . 0.0 110.875 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.849 " O5'" ' H8 ' ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.433 1.57 0 O4'-C1'-N19 111.205 3.005 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.837 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.269 0 O4'-C1'-N19 111.237 3.037 . 0.149 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.669 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.4 0 O4'-C1'-N19 111.132 2.932 . 0.147 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.642 " C5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.244 0 O4'-C1'-N19 111.124 2.924 . 0.112 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.622 " C5'" " O2'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.034 0 C5'-C4'-C3' 111.095 -2.937 . 0.165 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.544 HO2' " C5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.531 0 O4'-C1'-N19 111.05 2.85 . 0.033 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.554 ' H6 ' " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.054 0 O4'-C1'-N19 111.502 3.302 . 0.18 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.687 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.268 0 O4'-C1'-N19 110.965 2.765 . 0.178 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.687 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.367 0 O4'-C1'-N19 111.142 2.942 . 0.142 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.689 ' H6 ' " O5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.002 0 C5'-C4'-C3' 110.965 -3.024 . 0.259 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.641 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.459 0 C5'-C4'-C3' 111.154 -2.897 . 0.048 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.67 " O2'" " C5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.43 -1.908 0 C5'-C4'-C3' 110.867 -3.089 . 0.043 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.67 " C5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.425 0 C3'-C2'-C1' 104.414 3.237 . 0.015 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.667 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.17 0 O4'-C1'-N19 111.114 2.914 . 0.036 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.702 ' N3 ' ' N6 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.432 -1.746 0 C5'-C4'-C3' 111.079 -2.947 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.71 " H1'" ' OP2' ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.427 -2.128 0 O4'-C1'-N19 111.47 3.27 OUTLIER-EPSILON 0.0 OUTLIER alpha 0.0 . . . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.71 ' OP2' " H1'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.436 1.812 0 C5'-C4'-C3' 110.998 -3.001 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.702 ' N6 ' ' N3 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.797 0 C5'-C4'-C3' 110.896 -3.069 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.576 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.08 0 C5'-C4'-C3' 110.992 -3.005 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.72 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.795 0 O4'-C1'-N19 111.451 3.251 . 0.062 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.713 " O5'" ' H8 ' ' A' ' 21' ' ' ' A' . . . . . . . . 0 P--O5' 1.614 2.061 0 O4'-C1'-N19 111.613 3.413 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.866 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.615 2.215 0 O4'-C1'-N19 111.032 2.832 . 0.017 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.657 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.14 0 O4'-C1'-N19 111.934 3.734 . 0.077 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.853 ' H6 ' " O5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 P--O5' 1.614 2.099 0 C5'-C4'-C3' 111.383 -2.745 . 0.041 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.446 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.271 0 O4'-C1'-N19 111.158 2.958 . 0.229 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.604 HO2' " C5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.385 0 O4'-C1'-N19 111.232 3.032 . 0.482 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.9 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.055 0 O4'-C1'-N19 111.165 2.965 . 0.145 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.9 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.418 0 C3'-C2'-C1' 104.392 3.213 . 0.021 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.751 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.443 2.452 0 O4'-C1'-N19 111.179 2.979 . 0.208 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 0.837 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.158 0 O4'-C1'-N19 111.531 3.331 . 0.771 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 0.837 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.622 0 O4'-C1'-N19 111.348 3.148 . 0.162 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . 0.487 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.445 0 C5'-C4'-C3' 111.219 -2.854 . 0.352 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . 0.43 ' O ' ' N ' ' B' ' 366' ' ' LEU . . . . . . . . 0 N--CA 1.49 2.265 0 N-CA-C 112.51 -0.236 . . . . 0.0 112.51 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.03 87.05 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.792 0.329 . . . . 0.0 110.862 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . 0.43 ' N ' ' O ' ' B' ' 364' ' ' GLY . 0.3 OUTLIER -138.21 131.3 30.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.1 -179.712 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.535 ' O ' ' N ' ' B' ' 370' ' ' ALA . 4.8 t0 -57.58 -65.61 0.6 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.906 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.533 ' HA ' ' CE ' ' B' ' 371' ' ' LYS . 4.5 tmm? -36.86 -46.84 0.65 Allowed 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.338 0.589 . . . . 0.0 110.256 179.512 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -61.94 -40.71 96.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.684 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.609 ' CB ' ' CB ' ' B' ' 428' ' ' ALA . . . -63.79 -70.36 0.22 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.854 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.544 ' HG2' ' N ' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -35.67 -45.72 0.39 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.842 0.353 . . . . 0.0 110.294 -179.809 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.571 ' HG3' ' C2 ' ' A' ' 18' ' ' ' A' . 5.4 tmm_? -62.32 -39.78 94.17 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.861 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.562 ' N ' ' O ' ' B' ' 370' ' ' ALA . 4.3 tm0? -62.05 -58.4 7.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.281 0.562 . . . . 0.0 110.75 179.187 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.506 ' N ' ' CD2' ' B' ' 374' ' ' LEU . 0.9 OUTLIER -50.85 -70.39 0.09 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.992 -1.003 . . . . 0.0 113.136 -178.607 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . 0.526 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.0 m-85 -72.65 -49.92 28.58 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -177.305 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.55 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -65.61 -54.83 22.31 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -178.445 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . . . . . . . . . 3.3 tp -75.53 -26.43 58.05 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -177.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.468 ' HB ' ' O ' ' B' ' 374' ' ' LEU . 10.9 mm -125.18 -58.03 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.526 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -36.61 105.58 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.734 -0.746 . . . . 0.0 113.095 -179.302 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.569 ' CD2' HD11 ' B' ' 383' ' ' LEU . 18.1 p90 -119.58 171.48 8.34 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.758 0.313 . . . . 0.0 110.632 179.33 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . 0.526 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -62.9 104.42 0.55 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.087 -179.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 382' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 2.2 t 86.11 45.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.388 179.701 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.569 HD11 ' CD2' ' B' ' 380' ' ' TYR . 6.3 tt -97.72 -33.62 11.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.596 179.584 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . 0.506 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 0.0 OUTLIER 65.53 62.14 0.67 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.914 179.857 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.557 ' HG ' ' CG1' ' B' ' 406' ' ' VAL . 1.6 tt -108.45 127.97 54.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.661 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . 0.511 ' N ' HD21 ' B' ' 385' ' ' LEU . 35.7 p-80 -154.8 156.79 36.89 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -179.275 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.598 ' CE2' ' HB3' ' B' ' 404' ' ' CYS . 3.6 m-85 -112.45 152.43 28.72 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 114.374 -1.285 . . . . 0.0 110.892 178.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . 0.504 HG23 ' HB3' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -135.51 135.14 51.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.712 179.613 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.4 m -95.22 127.13 41.03 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.457 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.537 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 31.6 m -131.8 157.85 43.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.198 -179.685 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.537 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 87.38 21.73 0.06 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.52 179.737 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.535 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER 0.98 116.83 0.0 OUTLIER Pre-proline 0 N--CA 1.472 0.663 0 O-C-N 124.001 0.813 . . . . 0.0 112.476 179.884 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.492 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 20.5 Cg_exo -61.78 162.73 20.84 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 122.472 2.115 . . . . 0.0 112.641 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 394' ' ' THR . . . . . 0.428 ' CG2' ' C ' ' B' ' 393' ' ' PRO . 0.7 OUTLIER -155.49 166.11 34.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.159 -179.815 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -82.52 8.92 10.39 Favored 'General case' 0 CA--C 1.527 0.089 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.45 178.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 19.1 m -129.61 11.0 2.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.655 0.74 . . . . 0.0 109.208 178.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 168.68 60.07 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 114.605 -1.18 . . . . 0.0 109.297 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.492 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 90.3 Cg_exo -43.99 -54.58 3.71 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.047 2.498 . . . . 0.0 112.759 -179.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.545 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.7 OUTLIER -25.27 132.06 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.989 -178.483 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 400' ' ' SER . . . . . 0.469 ' HB2' ' HG3' ' B' ' 393' ' ' PRO . 4.5 t -137.94 152.84 49.36 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.795 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.536 HG13 ' N ' ' B' ' 402' ' ' VAL . 0.3 OUTLIER -114.92 141.21 32.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.067 0.46 . . . . 0.0 111.201 -179.631 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.536 ' N ' HG13 ' B' ' 401' ' ' ILE . 0.2 OUTLIER -106.27 158.24 6.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.431 179.672 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.504 ' HB3' HG23 ' B' ' 388' ' ' VAL . 63.4 tt0 -125.47 114.41 18.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.884 179.249 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.598 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -99.8 103.31 14.93 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.278 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.568 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.1 OUTLIER -144.41 169.36 18.07 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.327 -179.25 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.557 ' CG1' ' HG ' ' B' ' 385' ' ' LEU . 0.9 OUTLIER -149.76 -177.25 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.336 -178.942 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 56.57 -104.52 0.38 Allowed Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.658 179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -155.25 18.44 0.42 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.874 0.369 . . . . 0.0 110.936 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 169.32 33.55 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 121.001 -0.619 . . . . 0.0 112.284 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.568 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 1.2 m -120.07 111.72 18.24 Favored 'General case' 0 C--O 1.22 -0.498 0 O-C-N 123.0 -0.118 . . . . 0.0 110.756 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 57.8 t -105.14 104.18 16.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.65 0.262 . . . . 0.0 110.53 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.515 ' N ' ' CD1' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -62.33 -26.89 68.68 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 179.345 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . 0.473 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 172.44 -171.57 44.37 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.121 -1.037 . . . . 0.0 113.181 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.461 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -145.79 147.68 32.13 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.664 -0.268 . . . . 0.0 110.704 -179.671 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.479 ' HA2' ' HG2' ' B' ' 426' ' ' ARG . . . -140.72 150.36 21.64 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 119.9 -1.143 . . . . 0.0 112.936 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . 0.457 ' CG2' ' HB ' ' B' ' 401' ' ' ILE . 1.6 p -152.02 137.3 10.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.788 0.327 . . . . 0.0 111.355 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.545 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -149.74 177.36 27.93 Favored Glycine 0 C--O 1.226 -0.344 0 C-N-CA 120.856 -0.688 . . . . 0.0 111.962 179.676 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.527 ' N ' HD11 ' B' ' 422' ' ' ILE . 4.4 ptt85 -85.5 -45.52 11.72 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -179.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.663 ' O ' ' N ' ' B' ' 421' ' ' LYS . 14.8 t30 -98.85 39.68 1.25 Allowed 'General case' 0 C--O 1.223 -0.332 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.589 ' O ' ' N ' ' B' ' 423' ' ' ALA . 1.0 OUTLIER 46.34 -47.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 179.069 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.663 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -42.35 -58.22 2.28 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 118.378 0.536 . . . . 0.0 109.893 -179.081 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.615 ' O ' ' CB ' ' B' ' 426' ' ' ARG . 0.1 OUTLIER -46.69 -17.57 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.567 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.916 178.246 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.589 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -86.49 -49.84 7.29 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -57.33 -46.48 91.75 Favored Glycine 0 C--N 1.34 0.774 0 C-N-CA 119.824 -1.179 . . . . 0.0 110.781 178.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . 0.493 ' CD1' ' N ' ' B' ' 425' ' ' ILE . 1.3 mp -66.55 -65.0 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.068 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.615 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -39.7 -31.62 0.11 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.045 178.691 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.479 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -63.7 -59.88 4.02 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.462 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.609 ' CB ' ' CB ' ' B' ' 370' ' ' ALA . . . -58.95 -54.32 48.43 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 178.296 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.573 ' O ' ' CD2' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -53.12 -18.09 1.97 Allowed 'General case' 0 C--N 1.334 -0.076 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.339 178.602 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.525 ' ND2' ' O ' ' B' ' 426' ' ' ARG . 0.7 OUTLIER -82.07 -36.39 27.7 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.311 178.985 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.498 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -71.15 -37.17 72.25 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -178.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.573 ' CD2' ' O ' ' B' ' 429' ' ' GLU . 0.0 OUTLIER -83.85 12.2 6.44 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.044 179.968 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -99.17 -8.98 24.34 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.389 -179.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . 0.483 ' O ' ' HG ' ' B' ' 438' ' ' LEU . 29.8 t0 -108.68 87.36 2.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.068 0.461 . . . . 0.0 111.203 -179.602 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.568 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -53.0 -53.15 54.4 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.088 -179.963 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.568 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 7.5 mttm -52.15 -46.72 65.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.99 -179.597 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.482 ' O ' ' HB3' ' B' ' 440' ' ' PHE . 14.3 tmm? -68.4 -50.85 49.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.979 0.419 . . . . 0.0 110.338 179.476 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' B' ' 434' ' ' ASP . 58.3 mt -51.73 -62.37 1.67 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.546 179.419 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . 0.459 ' O ' ' HB3' ' B' ' 442' ' ' ALA . 48.9 t0 -57.37 -39.18 75.48 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.232 178.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.482 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.0 OUTLIER -45.94 -49.76 15.43 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.189 179.497 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.472 ' CE2' ' CE2' ' B' ' 440' ' ' PHE . 60.8 m-85 -65.15 -37.42 87.34 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.504 179.313 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . 0.507 ' O ' ' N ' ' B' ' 445' ' ' ARG . . . -45.52 -62.07 1.43 Allowed 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 178.23 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -48.36 -47.66 37.07 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 178.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.489 ' O ' ' CG2' ' B' ' 448' ' ' ILE . 2.5 mm100 -65.67 -5.7 9.23 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.046 178.802 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.54 ' O ' ' CG1' ' B' ' 448' ' ' ILE . 0.0 OUTLIER -89.51 -42.25 11.57 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.1 179.79 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -71.46 -31.14 66.82 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.986 179.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . 0.462 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -67.75 -63.63 1.02 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.409 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.54 ' CG1' ' O ' ' B' ' 445' ' ' ARG . 1.1 pt -27.45 132.77 0.16 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.95 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -74.89 2.6 6.39 Favored 'Trans proline' 0 N--CA 1.465 -0.163 0 C-N-CA 122.821 2.347 . . . . 0.0 112.344 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 39.8 58.0 2.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.69 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 9.3 t -65.0 -40.52 95.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.034 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 70.07 29.64 3.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.982 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.916 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.752 " O2'" ' H8 ' ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.779 0 C3'-C2'-C1' 104.709 3.566 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.752 ' H8 ' " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.155 0 O4'-C1'-N19 111.113 2.913 . 0.231 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.579 " O2'" " O5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.384 0 C5'-C4'-C3' 111.024 -2.984 . 0.165 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.579 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.358 0 C5'-C4'-C3' 111.055 -2.963 . 0.077 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.56 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.002 0 O4'-C1'-N19 111.2 3.0 . 0.194 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.521 ' OP1' ' CG ' ' B' ' 393' ' ' PRO . . . . . . . . 0 O4'--C4' 1.424 -2.426 0 C5'-C4'-C3' 111.099 -2.934 . 0.032 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.592 ' H6 ' " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.22 0 O4'-C1'-N19 111.556 3.356 . 0.175 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.429 ' C6 ' " H2'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.443 2.433 0 O4'-C1'-N19 111.149 2.949 . 0.269 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.447 " H2'" ' C6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.334 0 O4'-C1'-N19 111.215 3.015 . 0.108 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.673 ' H6 ' " O5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.436 1.829 0 C5'-C4'-C3' 111.186 -2.876 . 0.086 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.613 " O2'" " O5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.43 0 O4'-C1'-N19 111.169 2.969 . 0.018 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.773 " O5'" ' H6 ' ' A' ' 12' ' ' ' U' . . . . . . . . 0 P--O5' 1.612 1.935 0 O4'-C1'-N19 111.068 2.868 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.758 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.542 0 C3'-C2'-C1' 104.885 3.761 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.696 ' C4 ' ' C4 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.554 0 C5'-C4'-C3' 111.165 -2.89 . 0.02 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.696 ' C4 ' ' C4 ' ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.894 0 O4'-C1'-N19 111.114 2.914 . 0.039 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.666 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.432 -1.772 0 O4'-C1'-N19 111.389 3.189 . 0.3 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.646 ' C2 ' ' NH1' ' B' ' 372' ' ' ARG . . . . . . . . 0 O4'--C4' 1.429 -1.972 0 O4'-C1'-N19 111.344 3.144 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.79 " O5'" ' H8 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.708 0 C5'-C4'-C3' 110.968 -3.022 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.605 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.089 0 C5'-C4'-C3' 111.069 -2.954 . 0.054 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.746 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.846 0 C5'-C4'-C3' 111.071 -2.952 . 0.165 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.722 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.658 0 C3'-C2'-C1' 104.855 3.728 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.841 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.994 0 O4'-C1'-N19 111.168 2.968 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.79 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.334 0 O4'-C1'-N19 111.46 3.26 . 0.048 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.718 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.107 0 O4'-C1'-N19 110.817 2.617 . 0.098 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.451 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.33 0 O4'-C1'-N19 111.275 3.075 . 0.273 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.519 " O2'" " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.512 0 O4'-C1'-N19 111.211 3.011 . 0.09 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.884 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.436 1.839 0 O4'-C1'-N19 111.112 2.912 . 0.117 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.884 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.499 0 C3'-C2'-C1' 104.686 3.54 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.809 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.271 0 O4'-C1'-N19 111.252 3.052 . 0.14 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 1.006 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.227 0 O4'-C1'-N19 111.303 3.103 . 0.458 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 1.006 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.636 0 O4'-C1'-N19 111.108 2.908 . 0.166 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . 0.457 " O4'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.604 0 O4'-C1'-N19 111.137 2.937 . 0.588 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.108 0 N-CA-C 112.485 -0.246 . . . . 0.0 112.485 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 365' ' ' SER . . . . . 0.474 ' O ' HD11 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -121.72 30.49 6.66 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.837 0.351 . . . . 0.0 110.915 179.859 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . 0.475 HD12 ' HB3' ' B' ' 367' ' ' ASP . 0.1 OUTLIER -75.34 173.1 11.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.34 179.786 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.475 ' HB3' HD12 ' B' ' 366' ' ' LEU . 30.0 t70 -41.93 -77.45 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.426 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.559 ' HA ' ' CD ' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -36.11 -41.72 0.27 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.52 179.414 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . 0.525 ' N ' ' HG3' ' B' ' 368' ' ' MET . 2.8 m-80 -63.96 -45.82 87.41 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.034 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.645 ' O ' ' N ' ' B' ' 373' ' ' GLN . . . -61.92 -68.53 0.31 Allowed 'General case' 0 C--O 1.223 -0.322 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 179.441 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.606 ' HE2' ' N3 ' ' A' ' 20' ' ' ' A' . 0.0 OUTLIER -35.64 -44.89 0.34 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.795 0.331 . . . . 0.0 110.547 179.946 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.646 ' NH1' ' C2 ' ' A' ' 17' ' ' ' A' . 0.0 OUTLIER -64.64 -36.03 82.92 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-O 121.329 0.585 . . . . 0.0 110.247 179.209 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.645 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -62.51 -46.1 89.95 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.98 179.46 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.596 ' N ' ' CD2' ' B' ' 374' ' ' LEU . 0.1 OUTLIER -71.71 -65.73 0.72 Allowed 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -178.126 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . 0.631 ' CE1' ' CD1' ' B' ' 385' ' ' LEU . 2.5 m-85 -78.96 -7.25 57.87 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.337 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.556 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.2 OUTLIER -128.2 4.13 5.79 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.851 0.686 . . . . 0.0 112.851 -179.12 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.506 ' HB3' ' O ' ' B' ' 373' ' ' GLN . 49.4 tp -152.52 -2.74 0.25 Allowed 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -179.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.563 ' HB ' ' CB ' ' B' ' 441' ' ' TYR . 0.7 OUTLIER -131.52 -51.93 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.101 0 C-N-CA 119.442 -0.903 . . . . 0.0 112.324 179.602 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.539 ' N ' HD12 ' B' ' 378' ' ' ILE . . . -114.36 -151.45 10.36 Favored Glycine 0 N--CA 1.445 -0.765 0 C-N-CA 119.529 -1.32 . . . . 0.0 113.607 -179.117 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.55 ' CZ ' ' CG2' ' B' ' 448' ' ' ILE . 0.1 OUTLIER -155.09 -84.47 0.06 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.175 -0.513 . . . . 0.0 110.124 -179.389 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -170.59 25.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.692 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 382' ' ' SER . . . . . 0.471 ' O ' ' HG2' ' B' ' 384' ' ' ARG . 0.1 OUTLIER -131.73 -43.71 0.99 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.668 0.27 . . . . 0.0 111.034 179.874 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.526 HD23 ' CA ' ' B' ' 379' ' ' GLY . 1.1 pp -61.32 -15.01 31.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.949 0.404 . . . . 0.0 110.772 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . 0.471 ' HG2' ' O ' ' B' ' 382' ' ' SER . 15.0 mmt180 70.1 66.93 0.22 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.693 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.631 ' CD1' ' CE1' ' B' ' 375' ' ' TYR . 0.0 OUTLIER -102.12 132.8 47.8 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.88 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . 0.501 ' N ' HD21 ' B' ' 385' ' ' LEU . 30.8 p-80 -176.31 -177.39 0.86 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.627 0.727 . . . . 0.0 112.684 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.575 ' CE2' ' HB3' ' B' ' 404' ' ' CYS . 2.6 m-85 -118.96 165.18 14.41 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-N 114.749 -1.114 . . . . 0.0 110.156 178.617 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . 0.414 HG21 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -149.62 112.3 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 CA-C-O 121.484 0.659 . . . . 0.0 112.047 179.388 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 13.2 m -72.76 130.01 39.51 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.974 179.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.53 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 29.6 m -136.96 153.22 29.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.985 -179.672 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.53 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 86.16 28.47 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.351 -179.406 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.507 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.8 OUTLIER -8.58 119.06 0.03 OUTLIER Pre-proline 0 N--CA 1.467 0.41 0 O-C-N 124.148 0.905 . . . . 0.0 112.587 -179.717 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.521 ' CG ' ' OP1' ' A' ' 6' ' ' ' A' . 2.0 Cg_endo -49.09 167.68 0.13 Allowed 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.703 2.269 . . . . 0.0 112.591 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 394' ' ' THR . . . . . 0.466 HG22 ' O ' ' B' ' 393' ' ' PRO . 52.2 p -150.33 158.86 44.62 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.39 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -77.65 5.7 8.72 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 120.962 0.41 . . . . 0.0 111.139 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 15.2 m -133.22 12.98 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.535 0.683 . . . . 0.0 109.387 178.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 174.22 56.93 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.004 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.51 ' O ' ' C ' ' B' ' 399' ' ' ASN . 60.0 Cg_exo -35.72 -57.1 0.54 Allowed 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 123.081 2.52 . . . . 0.0 112.71 -179.899 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.542 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 2.0 m-20 -13.52 125.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.924 -179.404 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 38.7 t -132.33 142.37 49.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.781 179.199 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.53 HD12 ' CG2' ' B' ' 416' ' ' VAL . 0.1 OUTLIER -109.6 134.13 52.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-O 121.104 0.478 . . . . 0.0 111.328 -179.366 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.465 ' O ' ' OG1' ' B' ' 414' ' ' THR . 2.0 t -98.16 154.73 3.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.76 179.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.414 ' CB ' HG21 ' B' ' 388' ' ' VAL . 8.4 mm-40 -130.7 104.29 7.1 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.367 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.575 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -92.5 107.22 19.05 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.659 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.508 ' HA ' ' O ' ' B' ' 410' ' ' THR . 10.5 ptm180 -147.21 164.95 31.52 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.894 -179.423 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.549 ' CG1' HD21 ' B' ' 385' ' ' LEU . 1.6 m -144.2 144.44 22.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.01 -179.544 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 68.56 3.86 35.66 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.42 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 67.11 12.31 8.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.704 0.288 . . . . 0.0 110.799 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -133.68 -5.19 2.91 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.474 -0.869 . . . . 0.0 113.239 -179.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.508 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 63.8 m -130.06 122.98 29.4 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-N 116.992 0.396 . . . . 0.0 111.935 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 9.6 t -107.26 96.07 4.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.834 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.47 ' CD1' ' SD ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -54.53 -21.86 11.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.011 0.434 . . . . 0.0 110.301 179.648 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 160.12 -161.51 32.52 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.69 -0.766 . . . . 0.0 112.299 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 414' ' ' THR . . . . . 0.47 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 8.8 t -160.25 167.68 27.03 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.121 0.486 . . . . 0.0 111.471 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.512 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -141.3 154.61 24.69 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.654 -0.784 . . . . 0.0 113.582 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . 0.53 ' CG2' HD12 ' B' ' 401' ' ' ILE . 85.9 t -148.15 100.86 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 120.761 0.315 . . . . 0.0 110.777 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.542 ' O ' ' HA ' ' B' ' 399' ' ' ASN . . . -113.95 162.53 12.36 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.626 -0.797 . . . . 0.0 111.768 179.756 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.502 ' N ' HD13 ' B' ' 422' ' ' ILE . 0.0 OUTLIER -83.38 -50.68 8.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 117.125 0.462 . . . . 0.0 111.027 179.994 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.65 ' O ' ' CG2' ' B' ' 420' ' ' ILE . 0.5 OUTLIER -80.01 -23.93 41.17 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 120.972 -0.291 . . . . 0.0 110.767 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.65 ' CG2' ' O ' ' B' ' 419' ' ' ASN . 1.2 pp 110.54 -39.77 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 124.523 1.129 . . . . 0.0 110.842 -179.631 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.501 ' O ' ' N ' ' B' ' 424' ' ' GLY . 0.3 OUTLIER -45.86 -63.08 1.06 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.994 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.539 ' O ' ' CG ' ' B' ' 426' ' ' ARG . 0.1 OUTLIER -45.34 -24.45 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.282 177.316 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.569 ' CB ' ' O ' ' B' ' 420' ' ' ILE . . . -72.75 -51.76 17.81 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.092 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . 0.501 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -64.0 -54.6 29.41 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.25 -0.976 . . . . 0.0 111.322 179.341 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . 0.455 HG23 ' OE2' ' B' ' 429' ' ' GLU . 2.1 mm -62.6 -71.08 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.575 0 CA-C-N 115.662 -0.269 . . . . 0.0 111.113 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.539 ' CG ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -46.34 -25.4 0.63 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.944 0.402 . . . . 0.0 110.83 -178.549 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.534 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -62.56 -54.58 37.64 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 176.576 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.547 ' CB ' ' HB2' ' B' ' 370' ' ' ALA . . . -53.59 -50.84 64.76 Favored 'General case' 0 C--O 1.243 0.753 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 177.62 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.528 ' HA ' HD23 ' B' ' 432' ' ' LEU . 29.2 mt-10 -61.38 -8.54 4.08 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 115.085 -0.962 . . . . 0.0 111.402 179.168 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.534 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 24.8 m120 -86.48 -39.6 16.12 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.537 178.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.561 ' CB ' ' OH ' ' B' ' 387' ' ' TYR . . . -70.87 -34.39 71.56 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 -179.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.591 ' C ' ' CD2' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -85.82 14.51 5.86 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.383 -0.527 . . . . 0.0 111.356 -179.897 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 8.2 ttt180 -94.89 -3.71 48.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.178 -179.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . 0.526 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 18.2 m-20 -113.59 73.1 0.8 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.328 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.555 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 6.5 ptmt -41.89 -52.65 4.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.856 0.36 . . . . 0.0 110.579 179.713 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.555 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 1.4 mtpp -55.87 -45.17 78.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.212 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.526 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 15.5 tmm? -65.82 -52.3 51.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.082 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.484 HD22 ' NE2' ' B' ' 373' ' ' GLN . 24.3 mt -53.62 -65.37 0.58 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.617 179.297 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -46.51 -49.09 18.99 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.731 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.534 ' CE2' ' CZ ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -48.37 -42.23 31.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.532 0.682 . . . . 0.0 109.377 179.999 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.563 ' CB ' ' HB ' ' B' ' 378' ' ' ILE . 45.4 m-85 -73.02 -37.88 66.76 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.2 179.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -51.7 -59.47 4.25 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 3.4 ttmt -49.08 -45.24 42.82 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.479 ' HB2' ' O ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -54.11 -49.04 70.04 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.058 178.543 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.546 ' O ' ' CD1' ' B' ' 448' ' ' ILE . 0.1 OUTLIER -57.72 -27.71 63.21 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.048 179.786 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -74.83 -41.61 59.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.976 0.417 . . . . 0.0 110.509 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . 0.478 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -70.4 -78.75 0.07 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.124 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.55 ' CG2' ' CZ ' ' B' ' 380' ' ' TYR . 0.2 OUTLIER 23.56 95.39 0.04 OUTLIER Pre-proline 0 N--CA 1.463 0.212 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.767 -179.844 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . 0.464 ' O ' ' HB2' ' B' ' 450' ' ' ARG . 50.3 Cg_endo -84.45 117.19 2.07 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 123.085 2.523 . . . . 0.0 112.306 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . 0.464 ' HB2' ' O ' ' B' ' 449' ' ' PRO . 0.0 OUTLIER 177.66 -67.15 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.139 -179.93 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -105.95 -22.33 12.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.174 -179.69 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 6.3 mp0 -137.61 108.81 6.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.935 0.398 . . . . 0.0 111.051 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 28.7 t . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.858 179.971 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ' G' . . . . . 0.468 " O5'" ' C8 ' ' A' ' 1' ' ' ' G' . . . . . . . . 0 C2'--C1' 1.511 -1.673 0 C5'-C4'-C3' 110.867 -3.089 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ' G' . . . . . 0.762 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.222 0 O4'-C1'-N19 111.185 2.985 . 0.119 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ' G' . . . . . 0.762 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.389 0 O4'-C1'-N19 111.144 2.944 . 0.117 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ' A' . . . . . 0.444 " H2'" ' C6 ' ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.328 0 O4'-C1'-N19 110.965 2.765 . 0.11 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ' U' . . . . . 0.627 " O2'" " H5'" ' A' ' 6' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.094 0 C5'-C4'-C3' 111.16 -2.893 . 0.096 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ' A' . . . . . 0.627 " H5'" " O2'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.313 0 C5'-C4'-C3' 111.177 -2.882 . 0.33 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ' C' . . . . . 0.548 ' C4 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.669 0 C3'-C2'-C1' 104.9 3.778 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ' C' . . . . . 0.564 " O2'" " O5'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.747 0 C3'-C2'-C1' 104.823 3.693 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ' A' . . . . . 0.889 " O2'" " H5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.214 0 O4'-C1'-N19 111.281 3.081 . 0.064 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ' U' . . . . . 0.889 " H5'" " O2'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.696 0 C3'-C2'-C1' 104.662 3.513 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ' G' . . . . . 0.599 " O5'" " O2'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.491 0 C5'-C4'-C3' 111.05 -2.966 . 0.038 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ' U' . . . . . 0.902 " O5'" ' H6 ' ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.435 1.759 0 C5'-C4'-C3' 110.802 -3.132 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ' U' . . . . . 0.796 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.489 0 C3'-C2'-C1' 104.885 3.761 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ' C' . . . . . 0.688 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.339 0 C5'-C4'-C3' 111.147 -2.902 . 0.087 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ' A' . . . . . 0.933 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.426 0 C5'-C4'-C3' 111.068 -2.955 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ' G' . . . . . 0.933 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.427 0 C5'-C4'-C3' 110.7 -3.2 OUTLIER-EPSILON 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ' A' . . . . . 0.685 ' OP2' " H4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.436 0 C3'-C2'-C1' 104.209 3.01 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ' A' . . . . . 0.626 ' N6 ' HO2' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.026 0 O4'-C1'-N19 110.852 2.652 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ' G' . . . . . 0.546 ' H22' ' NH2' ' B' ' 372' ' ' ARG . . . . . . . . 0 O4'--C4' 1.426 -2.21 0 C5'-C4'-C3' 111.172 -2.886 . 0.397 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ' A' . . . . . 0.748 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 P--O5' 1.612 1.884 0 C5'-C4'-C3' 111.197 -2.869 . 0.191 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ' A' . . . . . 0.742 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.457 0 C3'-C2'-C1' 104.612 3.457 . 0.013 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ' C' . . . . . 0.907 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.436 1.869 0 O4'-C1'-N19 111.028 2.828 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ' G' . . . . . 0.789 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.126 0 O4'-C1'-N19 111.323 3.123 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ' U' . . . . . 0.789 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.615 0 C3'-C2'-C1' 104.854 3.726 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ' G' . . . . . 0.608 " O5'" " O2'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.28 0 O4'-C1'-N19 110.998 2.798 . 0.034 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ' G' . . . . . 0.719 " O2'" " H5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.384 0 O4'-C1'-N19 111.159 2.959 . 0.454 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ' U' . . . . . 0.719 " H5'" " O2'" ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.294 0 O4'-C1'-N19 111.367 3.167 . 0.179 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ' A' . . . . . 0.715 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.665 0 C3'-C2'-C1' 104.692 3.547 . 0.024 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ' U' . . . . . 0.895 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.442 2.343 0 O4'-C1'-N19 111.169 2.969 . 0.184 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ' C' . . . . . 0.963 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.239 0 O4'-C1'-N19 111.514 3.314 . 0.123 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ' U' . . . . . 0.963 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.611 0 O4'-C1'-N19 111.244 3.044 . 0.171 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.703 0 C5'-C4'-C3' 111.123 -2.918 . 0.508 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.261 0 N-CA-C 112.469 -0.252 . . . . 0.0 112.469 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 365' ' ' SER . . . . . 0.458 ' HB2' ' OE2' ' B' ' 429' ' ' GLU . 12.1 m -90.28 47.52 1.45 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.917 0.389 . . . . 0.0 110.822 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 366' ' ' LEU . . . . . 0.507 ' O ' ' HB2' ' B' ' 369' ' ' ASN . 6.7 tp -41.18 150.49 0.08 Allowed 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.982 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 367' ' ' ASP . . . . . 0.486 ' HB3' HG13 ' B' ' 425' ' ' ILE . 1.0 OUTLIER -46.84 -72.86 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 179.133 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 368' ' ' MET . . . . . 0.559 ' SD ' ' N1 ' ' A' ' 18' ' ' ' A' . 3.5 tmm? -34.41 -42.48 0.14 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.773 179.591 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 369' ' ' ASN . . . . . 0.511 ' N ' ' HE2' ' B' ' 368' ' ' MET . 90.7 m-20 -59.99 -50.5 73.49 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.8 0.333 . . . . 0.0 110.704 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 370' ' ' ALA . . . . . 0.56 ' O ' ' N ' ' B' ' 373' ' ' GLN . . . -56.38 -68.31 0.22 Allowed 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 178.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 371' ' ' LYS . . . . . 0.425 ' C ' ' O ' ' B' ' 370' ' ' ALA . 2.5 mttm -33.85 -51.3 0.4 Allowed 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.9 179.809 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 372' ' ' ARG . . . . . 0.591 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.2 OUTLIER -56.64 -38.33 71.98 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.712 -179.843 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 373' ' ' GLN . . . . . 0.56 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -62.87 -57.14 11.85 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.696 0.76 . . . . 0.0 110.159 178.955 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 374' ' ' LEU . . . . . 0.579 ' CD1' ' CB ' ' B' ' 428' ' ' ALA . 1.8 mt -48.8 -74.75 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 1.5 m-30 -98.14 4.39 49.05 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 -176.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 376' ' ' SER . . . . . 0.591 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.1 OUTLIER -116.2 -2.04 12.26 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.077 0.465 . . . . 0.0 110.211 178.705 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 377' ' ' LEU . . . . . 0.53 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 0.4 OUTLIER -133.42 -39.04 0.92 Allowed 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.082 177.901 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 378' ' ' ILE . . . . . 0.437 HD11 ' HB3' ' B' ' 377' ' ' LEU . 0.7 OUTLIER -127.15 -142.79 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.672 179.501 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 379' ' ' GLY . . . . . 0.51 ' O ' ' O ' ' B' ' 380' ' ' TYR . . . 93.26 -22.62 33.85 Favored Glycine 0 C--N 1.332 0.342 0 C-N-CA 120.535 -0.84 . . . . 0.0 113.139 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 380' ' ' TYR . . . . . 0.619 ' CD2' ' HB3' ' B' ' 383' ' ' LEU . 0.2 OUTLIER 36.93 -175.23 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 115.258 1.577 . . . . 0.0 115.258 179.57 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -123.42 -21.46 5.31 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 113.734 -1.575 . . . . 0.0 111.183 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 37.9 t -160.14 44.84 0.22 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.136 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 383' ' ' LEU . . . . . 0.619 ' HB3' ' CD2' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -114.05 -3.99 13.24 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.861 0.362 . . . . 0.0 111.018 178.749 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 384' ' ' ARG . . . . . 0.507 ' O ' ' HA ' ' B' ' 406' ' ' VAL . 11.9 tpt180 75.86 71.63 0.08 Allowed 'General case' 0 C--O 1.227 -0.127 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 178.327 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 385' ' ' LEU . . . . . 0.517 ' HA ' ' CG1' ' B' ' 406' ' ' VAL . 7.3 tt -135.32 123.88 23.57 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.451 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 7.5 p-80 -158.91 146.17 17.47 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 -178.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 387' ' ' TYR . . . . . 0.58 ' CE1' ' SG ' ' B' ' 404' ' ' CYS . 39.2 m-85 -96.56 132.77 41.82 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 114.095 -1.411 . . . . 0.0 110.823 178.172 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 388' ' ' VAL . . . . . 0.448 HG21 ' O ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -122.17 130.82 74.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.52 179.575 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.1 m -91.96 121.17 33.3 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.291 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 390' ' ' VAL . . . . . 0.54 ' O ' ' CB ' ' B' ' 391' ' ' LYS . 27.5 m -128.9 152.35 36.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.309 -179.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 391' ' ' LYS . . . . . 0.542 ' O ' ' C ' ' B' ' 392' ' ' LYS . 4.7 tmtt? 87.66 24.87 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.311 179.572 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 392' ' ' LYS . . . . . 0.542 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.2 OUTLIER -4.72 116.95 0.02 OUTLIER Pre-proline 0 N--CA 1.473 0.696 0 O-C-N 124.016 0.822 . . . . 0.0 111.962 -179.964 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 393' ' ' PRO . . . . . 0.54 ' CG ' HG22 ' B' ' 420' ' ' ILE . 15.7 Cg_exo -65.35 162.03 35.31 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.351 2.034 . . . . 0.0 112.542 -179.345 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 394' ' ' THR . . . . . 0.47 ' O ' ' HD3' ' B' ' 398' ' ' PRO . 2.3 p -150.08 164.82 34.56 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.478 -0.783 . . . . 0.0 112.022 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 395' ' ' ALA . . . . . 0.512 ' CB ' ' O2 ' ' A' ' 29' ' ' ' U' . . . -81.6 5.29 18.57 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.603 179.451 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 396' ' ' VAL . . . . . 0.465 ' O ' ' HB3' ' B' ' 397' ' ' ASP . 26.1 m -123.41 11.54 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 CA-C-O 121.53 0.681 . . . . 0.0 109.462 178.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 397' ' ' ASP . . . . . 0.465 ' HB3' ' O ' ' B' ' 396' ' ' VAL . 2.0 p30 163.95 59.33 0.0 OUTLIER Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 114.803 -1.089 . . . . 0.0 109.841 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 398' ' ' PRO . . . . . 0.535 ' CB ' ' O ' ' B' ' 418' ' ' ARG . 21.5 Cg_exo -32.91 -57.4 0.31 Allowed 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 123.069 2.513 . . . . 0.0 112.368 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 399' ' ' ASN . . . . . 0.52 ' C ' ' O ' ' B' ' 398' ' ' PRO . 15.7 m120 -5.23 120.77 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 114.948 -1.023 . . . . 0.0 112.256 179.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 400' ' ' SER . . . . . 0.511 ' CB ' ' HG3' ' B' ' 393' ' ' PRO . 0.3 OUTLIER -144.15 139.4 28.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.886 179.949 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 401' ' ' ILE . . . . . 0.49 HG13 ' N ' ' B' ' 402' ' ' VAL . 1.9 tp -110.34 143.46 20.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.717 -179.537 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 402' ' ' VAL . . . . . 0.513 ' CG2' ' C ' ' B' ' 423' ' ' ALA . 0.4 OUTLIER -112.78 148.99 15.41 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.651 -179.568 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 403' ' ' GLU . . . . . 0.468 ' HA ' ' O ' ' B' ' 413' ' ' GLY . 2.1 mm-40 -127.74 128.72 45.86 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.745 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 404' ' ' CYS . . . . . 0.58 ' SG ' ' CE1' ' B' ' 387' ' ' TYR . 18.7 t -118.85 104.86 10.94 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 177.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . 0.463 ' HA ' ' O ' ' B' ' 410' ' ' THR . 3.1 ttp180 -110.96 158.2 19.03 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 124.126 0.891 . . . . 0.0 111.666 -178.3 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 406' ' ' VAL . . . . . 0.517 ' CG1' ' HA ' ' B' ' 385' ' ' LEU . 0.0 OUTLIER -154.7 159.62 3.0 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.668 -179.6 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 64.93 -94.82 0.18 Allowed Glycine 0 CA--C 1.518 0.259 0 CA-C-N 115.173 -0.921 . . . . 0.0 113.211 179.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -141.61 20.55 2.19 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 111.555 0.206 . . . . 0.0 111.555 -179.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 151.82 -14.46 0.79 Allowed Glycine 0 C--N 1.33 0.195 0 C-N-CA 120.234 -0.984 . . . . 0.0 112.96 179.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 410' ' ' THR . . . . . 0.472 ' HB ' HG22 ' B' ' 406' ' ' VAL . 95.0 m -53.58 108.77 0.37 Allowed 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 411' ' ' VAL . . . . . 0.462 HG23 ' HB2' ' B' ' 405' ' ' ARG . 24.2 t -124.07 106.61 17.21 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.742 0 CA-C-O 122.006 0.908 . . . . 0.0 111.523 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . 0.455 ' O ' ' HB3' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -102.62 -38.99 7.26 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 113.704 -1.589 . . . . 0.0 108.942 -179.878 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 413' ' ' GLY . . . . . 0.56 ' HA3' ' HB3' ' B' ' 404' ' ' CYS . . . -72.23 98.64 0.82 Allowed Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.069 -1.062 . . . . 0.0 112.535 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 414' ' ' THR . . . . . . . . . . . . . 3.7 m -134.79 93.68 3.06 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 415' ' ' GLY . . . . . 0.527 ' CA ' ' HG2' ' B' ' 426' ' ' ARG . . . -133.71 147.3 18.99 Favored Glycine 0 C--O 1.226 -0.363 0 C-N-CA 119.523 -1.322 . . . . 0.0 114.394 -178.485 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 10.5 p -127.87 154.1 38.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.312 -0.444 . . . . 0.0 110.173 179.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . 0.502 ' HA3' ' CD1' ' B' ' 422' ' ' ILE . . . -165.1 155.72 27.27 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 119.948 -1.12 . . . . 0.0 113.039 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 418' ' ' ARG . . . . . 0.535 ' O ' ' CB ' ' B' ' 398' ' ' PRO . 0.0 OUTLIER -70.77 -41.98 71.0 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.867 0.365 . . . . 0.0 111.361 -179.939 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 419' ' ' ASN . . . . . 0.534 ' N ' ' OD1' ' B' ' 419' ' ' ASN . 0.1 OUTLIER -100.36 23.97 9.46 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.184 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 420' ' ' ILE . . . . . 0.578 ' O ' ' N ' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 56.51 -43.09 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 179.247 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 421' ' ' LYS . . . . . 0.617 ' CD ' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -45.17 -57.71 3.74 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 179.282 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 422' ' ' ILE . . . . . 0.617 ' N ' ' CD ' ' B' ' 421' ' ' LYS . 0.0 OUTLIER -45.78 -26.76 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.56 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.601 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . 0.578 ' N ' ' O ' ' B' ' 420' ' ' ILE . . . -77.26 -47.92 18.85 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 177.233 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 424' ' ' GLY . . . . . 0.565 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -57.89 -53.48 45.02 Favored Glycine 0 N--CA 1.447 -0.58 0 N-CA-C 110.058 -1.217 . . . . 0.0 110.058 178.079 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 425' ' ' ILE . . . . . 0.486 HG13 ' HB3' ' B' ' 367' ' ' ASP . 0.7 OUTLIER -59.15 -67.67 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 177.653 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 426' ' ' ARG . . . . . 0.567 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 3.5 tpt180 -35.86 -33.76 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.201 179.213 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 427' ' ' ALA . . . . . 0.47 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -63.33 -58.17 7.98 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.512 178.478 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 428' ' ' ALA . . . . . 0.579 ' CB ' ' CD1' ' B' ' 374' ' ' LEU . . . -58.25 -53.87 53.35 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 178.476 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 429' ' ' GLU . . . . . 0.458 ' OE2' ' HB2' ' B' ' 365' ' ' SER . 1.1 tt0 -49.14 -25.02 1.9 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.365 178.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 430' ' ' ASN . . . . . 0.47 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 2.4 m-80 -78.34 -36.89 45.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.477 179.114 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 431' ' ' ALA . . . . . 0.497 ' O ' ' CE ' ' B' ' 437' ' ' MET . . . -67.73 -41.77 82.94 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.487 -179.372 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 432' ' ' LEU . . . . . 0.562 ' HA ' ' CD2' ' B' ' 438' ' ' LEU . 0.6 OUTLIER -81.05 6.88 12.24 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.041 -179.839 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.47 -10.75 59.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.711 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 434' ' ' ASP . . . . . 0.459 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 0.8 OUTLIER -126.25 89.95 3.1 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.609 -0.437 . . . . 0.0 112.009 -178.991 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 435' ' ' LYS . . . . . 0.561 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 12.4 ptmt -53.79 -51.36 63.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.2 179.198 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 436' ' ' LYS . . . . . 0.561 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -51.95 -36.23 48.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.144 179.834 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 437' ' ' MET . . . . . 0.497 ' CE ' ' O ' ' B' ' 431' ' ' ALA . 14.9 tmm? -76.75 -50.47 13.5 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.944 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 438' ' ' LEU . . . . . 0.562 ' CD2' ' HA ' ' B' ' 432' ' ' LEU . 23.0 mt -53.02 -64.04 0.95 Allowed 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.735 0.779 . . . . 0.0 110.162 178.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 439' ' ' ASP . . . . . 0.525 ' O ' ' N ' ' B' ' 442' ' ' ALA . 6.1 t70 -50.55 -50.04 54.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.736 179.11 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 440' ' ' PHE . . . . . 0.41 ' HB3' ' O ' ' B' ' 436' ' ' LYS . 0.1 OUTLIER -43.03 -38.58 2.35 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.777 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 441' ' ' TYR . . . . . 0.526 ' O ' ' CG ' ' B' ' 444' ' ' GLN . 48.1 m-85 -74.33 -31.43 62.44 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.863 179.456 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 442' ' ' ALA . . . . . 0.525 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -59.01 -60.65 3.53 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 177.451 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.9 -37.47 19.84 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 178.104 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 444' ' ' GLN . . . . . 0.645 ' HG3' ' N ' ' B' ' 445' ' ' ARG . 0.0 OUTLIER -62.17 -47.14 85.82 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.384 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 445' ' ' ARG . . . . . 0.645 ' N ' ' HG3' ' B' ' 444' ' ' GLN . 0.0 OUTLIER -50.06 -35.1 23.77 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.083 179.589 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -86.63 -39.95 15.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.481 -179.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . -50.65 -45.45 57.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.912 -179.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 448' ' ' ILE . . . . . 0.556 ' CG1' ' O ' ' B' ' 445' ' ' ARG . 0.9 OUTLIER -42.75 122.3 2.9 Favored Pre-proline 0 C--N 1.324 -0.54 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.683 179.717 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 449' ' ' PRO . . . . . 0.446 ' O ' ' O ' ' B' ' 448' ' ' ILE . 84.7 Cg_exo -46.36 -176.19 0.0 OUTLIER 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.797 2.331 . . . . 0.0 112.698 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.96 170.86 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.619 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 451' ' ' SER . . . . . 0.43 ' O ' ' C ' ' B' ' 452' ' ' GLU . 1.3 m -57.96 96.14 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.576 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 452' ' ' GLU . . . . . 0.43 ' C ' ' O ' ' B' ' 451' ' ' SER . 0.2 OUTLIER 35.79 90.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.971 -179.674 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 13.8 t . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.931 179.954 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 366' ' ' LEU . . . . . 0.815 HD23 ' O ' ' B' ' 366' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.455 -0.202 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.479 ' O ' ' HG2' ' B' ' 371' ' ' LYS . 21.1 t70 26.12 -96.6 0.01 OUTLIER 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.344 -179.3 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.51 ' HE2' ' N ' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -41.7 -56.24 2.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.553 179.773 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 369' ' ' ASN . . . . . 0.51 ' N ' ' HE2' ' B' ' 368' ' ' MET . 0.6 OUTLIER -62.97 -34.39 77.41 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.829 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 1.021 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -62.59 -72.15 0.14 Allowed 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.852 179.176 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.479 ' HG2' ' O ' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -39.15 -38.18 0.46 Allowed 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.648 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.529 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.6 OUTLIER -61.83 -46.47 89.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.234 179.259 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.641 ' NE2' ' HG ' ' B' ' 377' ' ' LEU . 1.3 tm0? -60.98 -59.57 5.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.617 179.315 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 0.572 HD23 ' N ' ' B' ' 374' ' ' LEU . 0.7 OUTLIER -46.36 -69.97 0.11 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.109 -0.951 . . . . 0.0 112.025 -179.464 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 375' ' ' TYR . . . . . 0.523 ' O ' ' N ' ' B' ' 379' ' ' GLY . 1.9 m-85 -72.03 -61.16 1.89 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -177.812 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.529 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.6 OUTLIER -55.58 -56.88 15.2 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -178.478 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.641 ' HG ' ' NE2' ' B' ' 373' ' ' GLN . 0.2 OUTLIER -72.2 -45.51 60.02 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -178.273 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.78 HG22 HD11 ' B' ' 383' ' ' LEU . 11.3 mm -128.5 39.1 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.317 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' B' ' 375' ' ' TYR . . . -111.21 73.49 0.21 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.415 179.757 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.862 ' CD1' HD12 ' B' ' 383' ' ' LEU . 23.8 p90 -95.01 -164.64 1.19 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.669 0.271 . . . . 0.0 110.865 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 381' ' ' ALA . . . . . 0.575 ' O ' ' CE2' ' B' ' 380' ' ' TYR . . . -97.53 124.54 41.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.369 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 382' ' ' SER . . . . . 0.57 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 1.5 m 94.33 -10.93 0.12 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.97 179.253 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.862 HD12 ' CD1' ' B' ' 380' ' ' TYR . 5.1 tt -45.49 -39.99 7.9 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.112 0.482 . . . . 0.0 110.532 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 13.9 tpt85 67.33 64.76 0.42 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.929 179.314 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.561 ' HA ' HG12 ' B' ' 406' ' ' VAL . 0.1 OUTLIER -58.45 157.46 8.82 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.347 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 386' ' ' HIS . . . . . 0.525 ' CB ' ' O ' ' B' ' 405' ' ' ARG . 0.0 OUTLIER -158.67 72.65 0.6 Allowed 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -178.822 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.578 ' CZ ' ' HB3' ' B' ' 404' ' ' CYS . 5.7 m-85 -86.67 95.56 9.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.849 0.357 . . . . 0.0 110.089 177.135 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 388' ' ' VAL . . . . . 0.567 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -88.66 136.88 22.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.028 -179.7 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.2 m -97.12 126.43 42.29 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.084 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 0.965 HG23 HG23 ' B' ' 401' ' ' ILE . 28.0 m -132.33 153.21 37.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.5 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.545 ' O ' ' C ' ' B' ' 392' ' ' LYS . 6.6 tptt 87.3 21.87 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.501 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.545 ' C ' ' O ' ' B' ' 391' ' ' LYS . 6.7 mttp -8.72 122.41 0.02 OUTLIER Pre-proline 0 N--CA 1.472 0.647 0 O-C-N 123.839 0.712 . . . . 0.0 111.996 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.514 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 23.9 Cg_exo -62.83 163.04 23.17 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.787 2.325 . . . . 0.0 113.447 -178.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 394' ' ' THR . . . . . 0.625 ' OG1' HG22 ' B' ' 396' ' ' VAL . 0.1 OUTLIER -149.65 168.0 24.82 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.337 179.832 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -81.12 7.68 10.49 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.973 0.416 . . . . 0.0 111.159 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 396' ' ' VAL . . . . . 0.625 HG22 ' OG1' ' B' ' 394' ' ' THR . 5.2 m -129.26 13.59 2.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.425 0.631 . . . . 0.0 109.613 178.644 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 397' ' ' ASP . . . . . 0.523 ' OD1' ' CG2' ' B' ' 394' ' ' THR . 10.5 p30 163.51 63.12 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.382 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.528 ' O ' ' C ' ' B' ' 399' ' ' ASN . 75.9 Cg_exo -39.06 -51.35 2.5 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.852 2.368 . . . . 0.0 112.028 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.528 ' C ' ' O ' ' B' ' 398' ' ' PRO . 10.2 m120 -6.75 123.36 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.027 -0.988 . . . . 0.0 112.385 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 400' ' ' SER . . . . . 0.498 ' HB3' HG22 ' B' ' 420' ' ' ILE . 0.9 OUTLIER -140.49 137.97 34.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.581 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 0.965 HG23 HG23 ' B' ' 390' ' ' VAL . 0.5 OUTLIER -114.26 141.73 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-O 120.995 0.426 . . . . 0.0 111.18 -179.769 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.602 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.3 OUTLIER -107.87 152.41 9.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.277 -179.178 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 0.567 ' CB ' HG23 ' B' ' 388' ' ' VAL . 0.1 OUTLIER -115.63 98.91 6.97 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.217 178.931 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.655 ' O ' HD22 ' B' ' 412' ' ' LEU . 0.0 OUTLIER -78.43 92.32 4.59 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 179.325 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.594 ' HA ' ' O ' ' B' ' 410' ' ' THR . 5.7 ptp180 -139.14 157.45 45.93 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.498 -179.24 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.622 HG13 HD21 ' B' ' 412' ' ' LEU . 2.9 m -148.98 158.86 6.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.826 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 73.62 -1.61 43.96 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.82 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 14.6 t0 76.42 7.97 3.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.695 0.283 . . . . 0.0 111.246 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -157.76 17.61 0.34 Allowed Glycine 0 CA--C 1.519 0.338 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.92 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.753 HG21 ' OH ' ' B' ' 441' ' ' TYR . 0.2 OUTLIER -128.74 122.48 30.74 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 116.54 0.17 . . . . 0.0 111.044 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 36.0 t -113.21 103.45 15.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.602 0.239 . . . . 0.0 110.788 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.82 HD13 ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -67.79 -25.22 65.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.959 0.409 . . . . 0.0 110.024 179.546 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 413' ' ' GLY . . . . . 0.443 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 165.59 -165.36 37.89 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.313 -0.946 . . . . 0.0 112.843 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.473 ' CG2' ' O ' ' B' ' 402' ' ' VAL . 0.2 OUTLIER -150.68 157.41 42.93 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.657 0.265 . . . . 0.0 110.726 -179.766 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.498 ' HA2' ' HG2' ' B' ' 426' ' ' ARG . . . -149.73 152.29 24.26 Favored Glycine 0 C--O 1.226 -0.396 0 C-N-CA 120.044 -1.074 . . . . 0.0 113.226 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 416' ' ' VAL . . . . . 0.573 ' HB ' HD12 ' B' ' 401' ' ' ILE . 2.7 p -141.4 150.23 19.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.63 0.252 . . . . 0.0 110.898 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.876 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -163.0 161.34 33.81 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.445 -0.883 . . . . 0.0 112.608 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.493 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.0 OUTLIER -74.92 -42.86 56.93 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.807 0.337 . . . . 0.0 111.31 -179.787 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.753 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.7 OUTLIER -98.06 27.32 4.63 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.778 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.721 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 53.44 -44.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 178.903 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.648 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.6 OUTLIER -44.65 -56.8 4.09 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.975 -1.121 . . . . 0.0 107.975 179.867 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.876 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -46.29 -24.96 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.462 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 178.349 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.721 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -79.5 -48.74 13.38 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 177.434 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 424' ' ' GLY . . . . . 0.647 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -58.65 -52.82 50.78 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.284 -1.126 . . . . 0.0 110.284 178.071 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.518 ' N ' HD13 ' B' ' 425' ' ' ILE . 3.3 mm -58.43 -67.22 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 177.638 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.58 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 7.6 tpt180 -36.32 -32.16 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.237 178.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.647 ' HB3' ' O ' ' B' ' 424' ' ' GLY . . . -64.5 -55.13 22.7 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.431 178.553 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 1.021 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -56.88 -55.7 31.11 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.44 178.61 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.663 ' HA ' HD21 ' B' ' 432' ' ' LEU . 0.7 OUTLIER -53.5 -21.3 6.05 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.45 179.148 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.516 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.7 OUTLIER -75.65 -41.32 54.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.257 179.03 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.592 ' O ' HD21 ' B' ' 438' ' ' LEU . . . -67.25 -37.72 83.99 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.753 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.803 HD22 ' HA ' ' B' ' 370' ' ' ALA . 0.7 OUTLIER -83.9 9.57 11.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.716 0.293 . . . . 0.0 111.108 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -92.27 -11.72 34.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.245 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.526 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 32.7 m-20 -109.25 71.71 0.78 Allowed 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 120.687 0.279 . . . . 0.0 111.219 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.57 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -45.84 -54.01 8.79 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.433 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.57 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 7.5 mttt -48.19 -40.46 24.2 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.57 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.674 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.4 OUTLIER -77.73 -41.03 39.15 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 178.973 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.592 HD21 ' O ' ' B' ' 431' ' ' ALA . 95.7 mt -56.17 -65.04 0.67 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.966 179.173 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 439' ' ' ASP . . . . . 0.494 ' O ' ' N ' ' B' ' 442' ' ' ALA . 21.5 t70 -55.92 -46.42 78.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.267 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.497 ' HB2' ' O ' ' B' ' 436' ' ' LYS . 8.2 t80 -41.97 -45.12 3.71 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.28 -0.873 . . . . 0.0 108.903 179.276 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.753 ' OH ' HG21 ' B' ' 410' ' ' THR . 16.6 m-30 -67.62 -37.56 82.67 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.487 178.949 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 442' ' ' ALA . . . . . 0.494 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -47.61 -61.77 1.77 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 178.285 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.83 -57.34 11.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.643 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.439 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.3 OUTLIER -41.92 -62.88 0.82 Allowed 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.232 0.539 . . . . 0.0 110.36 179.011 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.602 ' HG2' ' CD1' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -43.22 -37.35 2.1 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.819 179.172 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -76.74 -41.05 46.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.919 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.322 -179.656 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 366' ' ' LEU . . . . . 0.496 HD12 ' HA ' ' B' ' 366' ' ' LEU . 2.8 tp . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.878 0.371 . . . . 0.0 111.347 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.54 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -45.67 -71.88 0.07 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.354 179.601 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.702 ' HE1' ' HB3' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -38.58 -35.48 0.19 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.14 -179.129 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 369' ' ' ASN . . . . . 0.702 ' HB3' ' HE1' ' B' ' 368' ' ' MET . 0.1 OUTLIER -67.71 -39.38 84.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.027 0.441 . . . . 0.0 109.904 179.779 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 0.58 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -62.27 -69.99 0.22 Allowed 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.134 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.543 ' HE3' ' N ' ' B' ' 368' ' ' MET . 0.4 OUTLIER -37.23 -44.93 0.61 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.13 179.428 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.547 ' O ' ' CB ' ' B' ' 376' ' ' SER . 1.4 tmm_? -56.27 -40.68 74.63 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.897 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.517 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -64.26 -48.51 75.47 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.076 0.465 . . . . 0.0 111.273 179.871 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 0.865 HD13 ' OH ' ' B' ' 387' ' ' TYR . 0.3 OUTLIER -59.72 -70.18 0.17 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -178.128 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 375' ' ' TYR . . . . . 0.553 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 4.6 m-85 -72.51 -34.49 67.65 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -177.218 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.547 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -83.58 -54.96 4.56 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.561 -179.323 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.537 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.2 OUTLIER -72.68 -35.84 67.77 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.625 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.537 HD13 ' O ' ' B' ' 377' ' ' LEU . 3.9 mm -137.01 36.78 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -178.515 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.553 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -127.04 90.71 0.36 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.212 -0.994 . . . . 0.0 112.824 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.687 ' CD2' HD12 ' B' ' 383' ' ' LEU . 52.3 p90 -99.74 -160.08 0.78 Allowed 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.397 -0.223 . . . . 0.0 110.397 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 381' ' ' ALA . . . . . 0.539 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -93.61 123.03 36.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.8 0.333 . . . . 0.0 111.622 -179.61 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 382' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 3.2 m 87.78 -3.66 0.56 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.017 179.03 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.687 HD12 ' CD2' ' B' ' 380' ' ' TYR . 6.2 tt -50.63 -43.67 57.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.807 0.337 . . . . 0.0 111.143 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 384' ' ' ARG . . . . . 0.55 ' O ' HG12 ' B' ' 406' ' ' VAL . 0.1 OUTLIER 69.84 74.09 0.23 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.674 -179.827 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.656 HD21 ' HE1' ' B' ' 387' ' ' TYR . 9.9 tt -118.68 128.95 55.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.124 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 41.1 p-80 -149.51 146.99 27.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.65 0.738 . . . . 0.0 112.85 -178.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.865 ' OH ' HD13 ' B' ' 374' ' ' LEU . 2.8 m-85 -101.66 141.75 34.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.661 -1.154 . . . . 0.0 110.532 178.558 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 388' ' ' VAL . . . . . 0.577 HG23 ' HB3' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -124.27 119.52 56.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.204 0.526 . . . . 0.0 110.777 179.317 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.8 m -80.12 122.99 27.49 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.817 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 0.657 HG23 ' CG2' ' B' ' 401' ' ' ILE . 31.5 m -131.86 161.01 42.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.76 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.785 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.2 OUTLIER 94.65 21.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.424 -179.908 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.533 ' O ' ' O ' ' B' ' 391' ' ' LYS . 0.7 OUTLIER 4.24 118.94 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.741 0 O-C-N 124.095 0.872 . . . . 0.0 112.829 179.742 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.488 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 7.0 Cg_exo -68.58 157.03 63.52 Favored 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.615 2.21 . . . . 0.0 113.586 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 394' ' ' THR . . . . . 0.432 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 0.6 OUTLIER -137.24 171.77 13.99 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.472 -1.24 . . . . 0.0 111.981 -179.624 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -93.39 18.75 9.23 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-O 121.289 0.566 . . . . 0.0 110.442 179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 34.6 m -135.67 -0.53 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.195 178.146 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 397' ' ' ASP . . . . . 0.434 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 1.6 m-20 179.25 56.24 0.06 OUTLIER Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 114.871 -1.059 . . . . 0.0 108.852 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.488 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 73.7 Cg_exo -38.57 -35.75 0.51 Allowed 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 123.282 2.654 . . . . 0.0 112.902 -179.251 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.623 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.4 OUTLIER -30.51 134.3 0.06 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.543 0.687 . . . . 0.0 112.212 -178.208 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 400' ' ' SER . . . . . 0.466 ' OG ' ' HG3' ' B' ' 393' ' ' PRO . 45.8 m -143.24 151.68 40.86 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.338 -179.681 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 0.785 HG22 ' HB2' ' B' ' 391' ' ' LYS . 10.2 tt -109.99 156.12 11.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.962 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.75 ' HB ' ' HB2' ' B' ' 427' ' ' ALA . 0.2 OUTLIER -121.19 152.98 24.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.641 -178.369 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 0.577 ' HB3' HG23 ' B' ' 388' ' ' VAL . 2.8 mt-10 -121.24 122.6 40.29 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.764 178.729 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.607 ' HB3' ' CZ ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -109.97 108.1 18.23 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 179.163 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.504 ' HA ' ' O ' ' B' ' 410' ' ' THR . 1.2 ptm180 -134.58 -170.02 2.46 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.683 0.754 . . . . 0.0 112.713 -178.455 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.895 HG23 ' HB ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -158.64 157.75 3.16 Favored 'Isoleucine or valine' 0 C--O 1.243 0.72 0 CA-C-N 114.492 -1.231 . . . . 0.0 112.003 -178.686 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 59.0 -95.08 0.06 OUTLIER Glycine 0 N--CA 1.448 -0.55 0 CA-C-N 114.737 -1.12 . . . . 0.0 111.957 -179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -167.08 27.1 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.753 0.311 . . . . 0.0 110.366 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 177.08 26.51 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 119.997 -1.097 . . . . 0.0 113.528 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.895 ' HB ' HG23 ' B' ' 406' ' ' VAL . 87.4 m -130.53 109.09 10.42 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 117.168 0.484 . . . . 0.0 110.815 178.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 411' ' ' VAL . . . . . 0.48 ' HA ' ' HA ' ' B' ' 405' ' ' ARG . 74.1 t -101.85 116.09 44.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.654 0.264 . . . . 0.0 110.521 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.763 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -71.58 -35.38 70.53 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.411 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 413' ' ' GLY . . . . . 0.494 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 172.38 -176.07 45.42 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.15 -1.024 . . . . 0.0 112.875 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.44 ' O ' ' CG ' ' B' ' 430' ' ' ASN . 0.5 OUTLIER -145.7 155.94 43.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.728 0.299 . . . . 0.0 111.294 -179.369 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.688 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -149.41 135.48 5.36 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.301 -0.952 . . . . 0.0 112.686 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 416' ' ' VAL . . . . . 0.543 ' HB ' HD12 ' B' ' 401' ' ' ILE . 8.8 p -125.87 152.51 33.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.76 0.314 . . . . 0.0 110.506 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.895 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -159.95 167.24 35.33 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.503 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.535 ' CG ' ' OD1' ' B' ' 419' ' ' ASN . 7.4 ptm180 -71.23 -41.92 69.53 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -179.317 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.697 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.3 OUTLIER -107.28 34.15 3.64 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.673 0.273 . . . . 0.0 110.802 179.575 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.724 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.7 OUTLIER 55.99 -42.57 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 179.292 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.541 ' N ' HG13 ' B' ' 420' ' ' ILE . 0.0 OUTLIER -45.0 -61.47 1.61 Allowed 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 118.954 0.797 . . . . 0.0 109.721 -179.795 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.895 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -45.31 -21.9 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 177.851 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.724 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -86.19 -50.53 6.91 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.595 178.231 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 424' ' ' GLY . . . . . 0.433 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -57.46 -42.52 93.9 Favored Glycine 0 C--N 1.337 0.624 0 C-N-CA 120.083 -1.056 . . . . 0.0 110.998 179.112 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.538 ' N ' ' CD1' ' B' ' 425' ' ' ILE . 0.6 OUTLIER -71.16 -63.38 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.237 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.594 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 12.2 tpt180 -41.37 -31.29 0.23 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.681 178.373 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.75 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -64.51 -60.35 3.24 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.449 178.609 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 0.613 ' O ' HD23 ' B' ' 432' ' ' LEU . . . -57.84 -51.9 67.68 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.809 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.552 ' O ' ' HB2' ' B' ' 433' ' ' ARG . 79.7 mm-40 -55.33 -21.59 15.61 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.079 178.904 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.53 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.6 OUTLIER -76.71 -38.81 53.7 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.138 178.881 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.654 ' HB3' HD22 ' B' ' 374' ' ' LEU . . . -62.42 -32.68 73.56 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.328 0.585 . . . . 0.0 109.49 179.417 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.775 ' HA ' HD21 ' B' ' 438' ' ' LEU . 0.2 OUTLIER -96.99 3.63 51.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.071 178.709 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 433' ' ' ARG . . . . . 0.552 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 0.0 OUTLIER -89.89 19.72 4.65 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.795 -179.964 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.533 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 15.5 m-20 -136.19 80.67 1.84 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.384 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.576 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.3 OUTLIER -47.18 -57.25 5.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.211 -179.905 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.576 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 2.5 mtmt -49.3 -42.49 41.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.28 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.763 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.5 OUTLIER -70.49 -50.31 39.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.585 179.603 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.775 HD21 ' HA ' ' B' ' 432' ' ' LEU . 85.4 mt -50.78 -59.58 3.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.469 0.652 . . . . 0.0 110.489 179.402 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -59.09 -42.66 90.99 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.47 178.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.505 ' C ' ' CD1' ' B' ' 440' ' ' PHE . 0.1 OUTLIER -42.81 -48.96 5.8 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 179.368 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.518 ' OH ' HG21 ' B' ' 410' ' ' THR . 55.1 m-85 -62.57 -46.3 88.98 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.56 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 442' ' ' ALA . . . . . 0.456 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -39.12 -61.69 0.73 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 178.659 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 1.4 tmtt? -49.47 -49.92 43.47 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 178.379 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.528 ' O ' ' N ' ' B' ' 447' ' ' ALA . 2.1 mt-30 -51.04 -59.01 4.62 Favored 'General case' 0 C--N 1.334 -0.085 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 178.878 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.483 ' HD3' ' HB3' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -38.1 -41.67 0.6 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.495 178.999 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -69.46 -38.16 77.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.896 179.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 447' ' ' ALA . . . . . 0.528 ' N ' ' O ' ' B' ' 444' ' ' GLN . . . . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.696 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 366' ' ' LEU . . . . . 0.451 ' HB3' ' HB2' ' B' ' 369' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.455 -0.193 0 CA-C-O 120.917 0.389 . . . . 0.0 110.906 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.646 ' HA ' HG23 ' B' ' 425' ' ' ILE . 33.9 t0 -61.04 -61.28 2.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.256 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.476 ' HA ' ' CE ' ' B' ' 371' ' ' LYS . 2.1 tmm? -35.51 -53.61 0.67 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.496 179.586 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 369' ' ' ASN . . . . . 0.451 ' HB2' ' HB3' ' B' ' 366' ' ' LEU . 2.1 m120 -60.19 -45.49 92.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.28 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 1.027 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -61.36 -71.7 0.14 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.244 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.476 ' CE ' ' HA ' ' B' ' 368' ' ' MET . 0.1 OUTLIER -34.94 -50.75 0.49 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.901 0.381 . . . . 0.0 110.473 -179.836 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.575 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.3 OUTLIER -55.56 -41.59 73.5 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.881 179.669 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.666 ' OE1' HD23 ' B' ' 377' ' ' LEU . 0.3 OUTLIER -66.1 -61.06 2.24 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.141 0.496 . . . . 0.0 110.798 179.601 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 1.072 HD11 ' CB ' ' B' ' 428' ' ' ALA . 0.4 OUTLIER -46.79 -73.24 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.577 0.955 . . . . 0.0 113.577 -178.571 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 375' ' ' TYR . . . . . 0.47 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.5 m-85 -92.3 -4.93 53.24 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -176.496 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.575 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -113.72 5.28 16.35 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.078 -0.649 . . . . 0.0 110.66 179.122 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.666 HD23 ' OE1' ' B' ' 373' ' ' GLN . 3.7 tp -144.51 -35.85 0.34 Allowed 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.281 179.579 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.672 HG23 ' CB ' ' B' ' 441' ' ' TYR . 5.5 mm -135.36 38.21 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -179.595 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.569 ' HA2' HD21 ' B' ' 383' ' ' LEU . . . -149.81 68.18 0.34 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.591 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.712 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 15.1 p90 -74.97 -50.9 15.09 Favored 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 121.071 -0.251 . . . . 0.0 110.696 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 381' ' ' ALA . . . . . 0.712 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 158.04 -14.75 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 178.863 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 382' ' ' SER . . . . . 0.438 ' HG ' ' HE2' ' B' ' 380' ' ' TYR . 0.5 OUTLIER -124.0 31.69 5.76 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -178.456 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.569 HD21 ' HA2' ' B' ' 379' ' ' GLY . 0.1 OUTLIER -101.0 -8.92 21.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.855 0.359 . . . . 0.0 110.537 178.703 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 57.4 44.05 22.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.145 -0.479 . . . . 0.0 109.95 -179.441 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.833 ' HA ' HG12 ' B' ' 406' ' ' VAL . 9.8 tt -90.96 125.84 35.9 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 386' ' ' HIS . . . . . 0.514 ' O ' ' O ' ' B' ' 405' ' ' ARG . 2.3 p-80 -144.96 148.89 34.31 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 -178.525 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.436 ' CE1' HD21 ' B' ' 385' ' ' LEU . 18.2 m-85 -109.63 148.91 30.49 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.738 -1.119 . . . . 0.0 109.549 177.765 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 388' ' ' VAL . . . . . 0.826 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -125.18 125.44 69.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.149 0.5 . . . . 0.0 110.699 179.44 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 389' ' ' THR . . . . . 0.522 ' CG2' ' O ' ' B' ' 389' ' ' THR . 0.5 OUTLIER -83.84 117.0 23.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.453 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 0.921 HG23 HG23 ' B' ' 401' ' ' ILE . 33.9 m -130.52 146.74 33.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.156 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.561 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.3 OUTLIER 94.0 19.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.092 -179.812 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.516 ' C ' ' O ' ' B' ' 391' ' ' LYS . 6.4 mttt -6.27 108.32 0.03 OUTLIER Pre-proline 0 N--CA 1.469 0.479 0 O-C-N 123.952 0.782 . . . . 0.0 112.579 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.494 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 5.5 Cg_exo -47.51 157.14 0.9 Allowed 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 122.661 2.241 . . . . 0.0 113.195 -179.55 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 394' ' ' THR . . . . . 0.486 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 1.3 p -150.35 164.95 34.51 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.934 -1.03 . . . . 0.0 111.429 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -78.18 5.93 9.18 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.842 0.353 . . . . 0.0 111.297 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 396' ' ' VAL . . . . . 0.492 ' O ' ' HB2' ' B' ' 397' ' ' ASP . 4.3 m -132.1 12.84 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.454 0.645 . . . . 0.0 109.352 178.629 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 397' ' ' ASP . . . . . 0.492 ' HB2' ' O ' ' B' ' 396' ' ' VAL . 32.1 t70 172.56 56.82 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.153 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.494 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 1.5 Cg_endo -44.41 -61.09 0.63 Allowed 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 123.253 2.635 . . . . 0.0 111.856 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.565 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 11.7 p30 -22.72 137.04 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.899 -1.046 . . . . 0.0 112.221 -179.212 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 45.9 t -140.57 154.78 46.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.945 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 0.921 HG23 HG23 ' B' ' 390' ' ' VAL . 0.4 OUTLIER -116.72 142.88 28.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.317 -179.742 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.716 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -107.4 156.35 7.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.666 -179.764 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 0.826 ' CB ' HG23 ' B' ' 388' ' ' VAL . 0.0 OUTLIER -121.6 110.48 16.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.258 179.114 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.802 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 5.7 t -90.5 100.09 12.99 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.855 179.479 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.514 ' O ' ' O ' ' B' ' 386' ' ' HIS . 6.3 ptm180 -143.25 161.99 36.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.392 0.615 . . . . 0.0 111.889 -178.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.833 HG12 ' HA ' ' B' ' 385' ' ' LEU . 5.3 m -142.13 151.01 18.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.289 179.648 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 71.32 3.58 53.67 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.02 -1.086 . . . . 0.0 112.081 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 69.28 21.96 6.85 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.737 0.304 . . . . 0.0 110.78 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -146.25 -46.66 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.424 -0.893 . . . . 0.0 113.182 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.49 ' O ' ' HB2' ' B' ' 405' ' ' ARG . 69.0 m -80.41 125.77 30.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.863 0.364 . . . . 0.0 111.669 -179.365 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 52.9 t -107.88 104.15 16.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.908 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.663 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.1 OUTLIER -61.47 -26.07 67.65 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.586 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 160.02 -154.14 25.16 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.466 -0.788 . . . . 0.0 112.3 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.598 ' OG1' HD11 ' B' ' 401' ' ' ILE . 4.6 t -163.25 162.8 25.47 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.108 0.48 . . . . 0.0 111.797 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.55 ' CA ' ' HG2' ' B' ' 426' ' ' ARG . . . -148.04 151.06 23.34 Favored Glycine 0 C--O 1.224 -0.509 0 C-N-CA 120.343 -0.932 . . . . 0.0 113.148 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 416' ' ' VAL . . . . . 0.674 ' HB ' HD12 ' B' ' 401' ' ' ILE . 5.5 p -142.8 149.6 18.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.728 0.299 . . . . 0.0 110.992 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.94 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -161.3 170.49 37.09 Favored Glycine 0 C--O 1.227 -0.334 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.345 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.519 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 0.0 OUTLIER -81.95 -44.0 17.33 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 116.903 0.351 . . . . 0.0 111.411 179.951 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.743 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.2 OUTLIER -99.99 37.08 1.7 Allowed 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 179.52 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.718 ' C ' HD12 ' B' ' 420' ' ' ILE . 0.6 OUTLIER 48.27 -46.47 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 N-CA-C 115.2 1.556 . . . . 0.0 115.2 178.468 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.706 ' N ' HD12 ' B' ' 420' ' ' ILE . 0.0 OUTLIER -43.3 -56.5 3.48 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -179.51 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.94 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -47.37 -22.26 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.887 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.716 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -83.17 -46.65 12.48 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 177.116 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 424' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -58.94 -51.5 58.82 Favored Glycine 0 C--N 1.334 0.431 0 N-CA-C 110.271 -1.131 . . . . 0.0 110.271 177.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.826 ' N ' HD13 ' B' ' 425' ' ' ILE . 0.9 OUTLIER -61.5 -66.33 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 177.893 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.595 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 7.0 tpt180 -39.02 -32.93 0.1 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.551 179.167 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' B' ' 424' ' ' GLY . . . -62.88 -57.67 10.03 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 178.422 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 1.072 ' CB ' HD11 ' B' ' 374' ' ' LEU . . . -58.24 -53.78 54.44 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.235 178.317 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.676 ' HA ' HD21 ' B' ' 432' ' ' LEU . 0.5 OUTLIER -54.47 -17.33 3.03 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.936 179.229 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.501 ' OD1' ' N ' ' B' ' 414' ' ' THR . 1.1 m-80 -81.77 -36.75 28.14 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 178.436 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.802 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -68.4 -39.43 81.68 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.349 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.752 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.8 OUTLIER -83.24 10.27 8.81 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.85 0.357 . . . . 0.0 111.013 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -86.95 -8.11 57.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.455 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.439 ' O ' ' HG ' ' B' ' 438' ' ' LEU . 1.1 m-20 -117.8 80.52 1.52 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.655 -179.381 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.569 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 1.9 ptpp? -49.68 -54.32 19.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.242 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.569 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -50.35 -39.01 45.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.098 0.475 . . . . 0.0 110.203 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.663 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.8 OUTLIER -76.52 -40.96 48.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.811 178.927 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.752 HD11 ' HA ' ' B' ' 432' ' ' LEU . 83.4 mt -58.36 -64.54 0.89 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.985 179.156 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -49.88 -43.35 49.29 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 178.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.486 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -45.32 -42.49 9.91 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.382 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.672 ' CB ' HG23 ' B' ' 378' ' ' ILE . 41.8 m-85 -66.62 -45.78 77.96 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.858 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 442' ' ' ALA . . . . . 0.435 ' O ' ' HB2' ' B' ' 445' ' ' ARG . . . -41.99 -59.74 1.64 Allowed 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.552 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -49.92 -44.59 50.43 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 178.138 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.518 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -63.12 -12.09 24.86 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.65 179.318 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.571 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -90.41 -36.85 14.35 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.821 -179.746 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -85.74 -37.4 19.39 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.939 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.801 -179.59 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 366' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.457 -0.101 0 CA-C-O 120.796 0.332 . . . . 0.0 111.017 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.544 ' HB3' ' CG1' ' B' ' 425' ' ' ILE . 0.3 OUTLIER -54.67 -68.48 0.18 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 179.44 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.544 ' N ' ' HE2' ' B' ' 371' ' ' LYS . 12.5 tmm? -34.84 -45.59 0.26 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.491 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -62.57 -44.41 96.39 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.872 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 0.755 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -60.36 -69.68 0.21 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 179.424 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.544 ' HE2' ' N ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -34.13 -51.02 0.42 Allowed 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.509 179.894 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.559 ' O ' ' CB ' ' B' ' 376' ' ' SER . 2.3 tmm_? -56.96 -40.05 75.76 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.783 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.62 ' NE2' ' HG ' ' B' ' 377' ' ' LEU . 1.1 tm0? -62.28 -59.03 5.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.121 0.486 . . . . 0.0 110.322 178.846 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 0.759 HD21 HD23 ' B' ' 432' ' ' LEU . 1.7 mt -47.56 -72.65 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.3 -0.864 . . . . 0.0 113.162 -178.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 375' ' ' TYR . . . . . 0.456 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 24.9 m-85 -74.18 -48.45 29.04 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 -176.817 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.559 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -63.25 -54.6 34.7 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.652 -178.576 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.62 ' HG ' ' NE2' ' B' ' 373' ' ' GLN . 0.2 OUTLIER -71.78 -43.85 65.0 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -178.331 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.595 HG22 HD13 ' B' ' 383' ' ' LEU . 8.7 mm -114.59 -58.98 3.34 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -177.648 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.456 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -63.56 66.44 0.04 OUTLIER Glycine 0 CA--C 1.516 0.131 0 C-N-CA 121.14 -0.553 . . . . 0.0 113.117 -179.123 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.683 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 10.4 p90 -49.01 -35.45 15.43 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 111.567 0.21 . . . . 0.0 111.567 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 381' ' ' ALA . . . . . 0.683 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 151.48 -10.31 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.586 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 382' ' ' SER . . . . . 0.43 ' O ' ' OH ' ' B' ' 380' ' ' TYR . 0.3 OUTLIER -147.43 50.85 1.07 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.916 0.389 . . . . 0.0 110.426 179.715 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.612 HD12 ' HE1' ' B' ' 380' ' ' TYR . 0.8 OUTLIER -106.13 -15.67 14.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.793 -179.961 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 384' ' ' ARG . . . . . 0.513 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 0.2 OUTLIER 65.89 60.6 0.67 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.111 179.808 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.89 ' HG ' HG12 ' B' ' 406' ' ' VAL . 2.6 tt -105.67 124.62 49.85 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 386' ' ' HIS . . . . . 0.544 ' O ' ' O ' ' B' ' 405' ' ' ARG . 15.2 p-80 -144.0 148.27 35.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.612 0.72 . . . . 0.0 112.746 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.621 ' OH ' HD13 ' B' ' 374' ' ' LEU . 35.3 m-85 -107.23 144.69 33.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.388 -0.823 . . . . 0.0 111.266 179.077 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 388' ' ' VAL . . . . . 0.685 HG23 ' HB3' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -125.83 125.92 69.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.762 179.332 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.1 m -88.01 122.43 31.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.209 -179.37 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 0.912 HG23 HG23 ' B' ' 401' ' ' ILE . 18.2 m -125.1 157.64 33.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.192 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.618 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.2 OUTLIER 89.56 24.07 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.197 179.954 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.52 ' C ' ' O ' ' B' ' 391' ' ' LYS . 8.2 mmpt? 5.44 108.51 0.01 OUTLIER Pre-proline 0 N--CA 1.471 0.605 0 O-C-N 123.938 0.774 . . . . 0.0 112.317 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.486 ' HD2' ' HA ' ' B' ' 392' ' ' LYS . 3.3 Cg_endo -51.31 162.57 1.29 Allowed 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.709 2.273 . . . . 0.0 113.891 -179.119 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 2.5 p -126.58 160.2 31.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.573 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -91.78 20.35 5.68 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-O 121.316 0.579 . . . . 0.0 110.573 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 396' ' ' VAL . . . . . 0.442 ' O ' ' CB ' ' B' ' 397' ' ' ASP . 23.1 m -138.32 13.52 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.323 177.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 397' ' ' ASP . . . . . 0.47 ' O ' ' N ' ' B' ' 399' ' ' ASN . 0.7 OUTLIER 159.23 64.28 0.0 OUTLIER Pre-proline 0 N--CA 1.451 -0.392 0 CA-C-N 114.659 -1.155 . . . . 0.0 108.79 -179.238 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.518 ' O ' ' C ' ' B' ' 399' ' ' ASN . 83.4 Cg_exo -37.34 -23.2 0.05 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.322 0 C-N-CA 123.63 2.886 . . . . 0.0 113.676 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.518 ' C ' ' O ' ' B' ' 398' ' ' PRO . 52.5 m-80 -20.57 109.4 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.271 0 O-C-N 123.537 0.523 . . . . 0.0 111.537 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 38.1 t -131.78 146.3 52.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.256 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 0.912 HG23 HG23 ' B' ' 390' ' ' VAL . 0.0 OUTLIER -108.29 151.76 10.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.37 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.696 ' HB ' ' HB2' ' B' ' 427' ' ' ALA . 0.2 OUTLIER -119.45 157.93 21.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.781 -178.692 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 0.685 ' HB3' HG23 ' B' ' 388' ' ' VAL . 0.7 OUTLIER -121.34 118.31 29.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.741 178.895 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.546 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -93.09 98.53 11.38 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.222 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.549 ' HA ' ' O ' ' B' ' 410' ' ' THR . 1.0 OUTLIER -133.69 158.2 43.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.348 0.594 . . . . 0.0 112.033 -178.291 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.994 HG13 HD21 ' B' ' 412' ' ' LEU . 2.6 m -138.88 178.65 3.77 Favored 'Isoleucine or valine' 0 C--O 1.238 0.463 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.234 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 407' ' ' GLY . . . . . 0.457 ' O ' ' HG2' ' B' ' 384' ' ' ARG . . . 64.77 -92.55 0.13 Allowed Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.898 -0.667 . . . . 0.0 112.375 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -163.64 25.94 0.08 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.902 0.382 . . . . 0.0 110.588 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 409' ' ' GLY . . . . . 0.474 ' HA2' ' NE ' ' B' ' 405' ' ' ARG . . . 163.66 -12.56 0.09 OUTLIER Glycine 0 CA--C 1.522 0.477 0 C-N-CA 120.445 -0.883 . . . . 0.0 113.643 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.549 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 42.4 m -71.8 134.24 46.03 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 117.531 0.665 . . . . 0.0 110.646 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 411' ' ' VAL . . . . . 0.566 HG13 ' OE1' ' B' ' 403' ' ' GLU . 80.3 t -119.18 114.11 43.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.742 0.306 . . . . 0.0 111.733 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.994 HD21 HG13 ' B' ' 406' ' ' VAL . 0.2 OUTLIER -75.29 -32.45 61.0 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.145 179.024 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 413' ' ' GLY . . . . . 0.457 ' O ' ' SG ' ' B' ' 404' ' ' CYS . . . 174.4 -168.74 41.58 Favored Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.003 -1.094 . . . . 0.0 113.319 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.504 ' OG1' HD11 ' B' ' 401' ' ' ILE . 0.1 OUTLIER -146.42 158.46 43.89 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.572 -0.314 . . . . 0.0 111.612 -179.161 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.586 ' CA ' ' CG ' ' B' ' 426' ' ' ARG . . . -152.06 138.11 6.3 Favored Glycine 0 C--O 1.225 -0.418 0 C-N-CA 120.451 -0.881 . . . . 0.0 112.833 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 416' ' ' VAL . . . . . 0.431 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 12.9 p -119.63 150.3 22.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 179.402 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.797 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -159.73 148.6 17.42 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.267 -0.968 . . . . 0.0 112.262 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.487 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 4.3 ptt85 -67.51 -42.47 82.78 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.788 0.327 . . . . 0.0 111.434 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.806 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.1 OUTLIER -100.3 26.74 6.26 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.959 179.358 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.795 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 55.14 -46.21 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 179.597 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.516 ' O ' ' N ' ' B' ' 424' ' ' GLY . 0.0 OUTLIER -44.53 -58.51 2.95 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 119.913 -0.715 . . . . 0.0 109.239 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.806 HD11 ' H ' ' B' ' 419' ' ' ASN . 0.1 OUTLIER -46.0 -27.92 0.75 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.426 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 177.563 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.795 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -70.97 -51.09 27.71 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 176.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 424' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -61.11 -44.2 98.46 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.23 -0.986 . . . . 0.0 111.474 178.676 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.681 ' N ' HD12 ' B' ' 425' ' ' ILE . 1.4 mp -81.63 -3.45 6.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 120.715 0.293 . . . . 0.0 111.391 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.612 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -96.71 -29.67 13.66 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 176.839 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.696 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -69.95 -42.58 73.04 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.531 -1.285 . . . . 0.0 107.531 176.783 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 0.755 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -63.13 -56.93 12.6 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.759 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' B' ' 425' ' ' ILE . 0.0 OUTLIER -51.41 -22.06 2.73 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.574 178.231 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.47 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.9 OUTLIER -79.47 -39.25 32.65 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.955 179.166 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.766 ' O ' HD21 ' B' ' 438' ' ' LEU . . . -67.25 -30.42 70.32 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.146 -179.281 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.969 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.2 OUTLIER -95.47 8.24 43.85 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.877 179.772 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.73 -17.23 36.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.077 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.558 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 0.7 OUTLIER -102.85 82.94 2.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.163 -179.12 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.569 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 12.0 ptmt -52.15 -54.69 27.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.924 0.392 . . . . 0.0 110.053 179.602 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.569 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 1.5 mmpt? -51.73 -42.67 62.48 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.59 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.974 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.2 OUTLIER -71.78 -48.99 42.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.004 0.43 . . . . 0.0 110.145 179.188 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.969 HD11 ' HA ' ' B' ' 432' ' ' LEU . 83.1 mt -52.97 -60.9 2.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.433 0.635 . . . . 0.0 110.019 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 439' ' ' ASP . . . . . 0.519 ' O ' ' N ' ' B' ' 442' ' ' ALA . 29.1 t70 -56.01 -44.35 78.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.264 -0.88 . . . . 0.0 108.897 178.647 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.482 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.6 OUTLIER -43.38 -45.01 5.96 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 179.343 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.54 ' HB3' HG23 ' B' ' 378' ' ' ILE . 45.5 m-85 -64.85 -39.42 93.53 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.936 178.368 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 442' ' ' ALA . . . . . 0.519 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -45.34 -62.54 1.22 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.069 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -45.87 -48.92 15.89 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 178.272 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.499 ' HB2' ' O ' ' B' ' 441' ' ' TYR . 0.2 OUTLIER -50.2 -54.58 19.94 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.037 178.148 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.604 ' HG2' ' CD1' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -41.71 -42.77 2.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.13 179.048 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -72.42 -38.0 68.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.286 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.022 -179.205 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 366' ' ' LEU . . . . . 0.501 ' O ' ' HB2' ' B' ' 369' ' ' ASN . 7.5 mt . . . . . 0 CA--C 1.52 -0.204 0 CA-C-O 120.628 0.251 . . . . 0.0 111.352 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.8 ' HA ' HG23 ' B' ' 425' ' ' ILE . 0.0 OUTLIER -45.75 -71.92 0.07 Allowed 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 178.844 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.503 ' HG2' ' N ' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -34.37 -44.61 0.2 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.558 179.311 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 369' ' ' ASN . . . . . 0.503 ' N ' ' HG2' ' B' ' 368' ' ' MET . 0.6 OUTLIER -56.33 -52.18 65.51 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.916 0.388 . . . . 0.0 110.529 179.25 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 0.802 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -61.22 -70.7 0.17 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.67 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.426 ' C ' ' O ' ' B' ' 370' ' ' ALA . 0.3 OUTLIER -36.6 -38.82 0.18 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.134 0.493 . . . . 0.0 110.428 179.924 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.572 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.0 OUTLIER -65.34 -42.32 92.98 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.883 179.799 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.646 ' HG2' HD22 ' B' ' 377' ' ' LEU . 0.1 OUTLIER -59.14 -44.75 92.07 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.583 0.706 . . . . 0.0 110.264 179.136 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 374' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -58.68 -69.77 0.18 Allowed 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 -178.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 375' ' ' TYR . . . . . 0.485 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 5.2 m-30 -96.67 12.03 33.28 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -176.68 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.759 ' O ' HD12 ' B' ' 377' ' ' LEU . 0.7 OUTLIER -129.81 -1.3 4.78 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.571 179.268 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.759 HD12 ' O ' ' B' ' 376' ' ' SER . 8.8 mp -140.25 -27.52 0.75 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.279 178.646 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.753 HD13 ' O ' ' B' ' 377' ' ' LEU . 4.5 mm -144.38 39.25 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.169 0 CA-C-O 120.644 0.259 . . . . 0.0 111.536 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.485 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -121.72 97.41 0.61 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.895 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.575 ' CE1' ' HB2' ' B' ' 383' ' ' LEU . 46.4 p90 -124.11 -172.98 2.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.639 0.257 . . . . 0.0 110.634 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 381' ' ' ALA . . . . . 0.505 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -96.36 83.17 3.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.42 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 382' ' ' SER . . . . . 0.505 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 3.2 t 157.7 -34.8 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.103 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.701 HD23 ' O ' ' B' ' 383' ' ' LEU . 1.2 tt -45.84 -42.18 12.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.744 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 384' ' ' ARG . . . . . 0.497 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 0.9 OUTLIER 62.55 59.58 1.47 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.761 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.778 ' HG ' HG12 ' B' ' 406' ' ' VAL . 7.0 tt -101.32 132.64 46.76 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.869 -179.515 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 386' ' ' HIS . . . . . 0.459 ' O ' ' O ' ' B' ' 405' ' ' ARG . 24.9 p-80 -149.78 151.9 34.32 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.3 0.572 . . . . 0.0 112.419 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.661 ' HE1' HD21 ' B' ' 385' ' ' LEU . 7.1 m-85 -107.26 150.01 27.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.009 178.402 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 388' ' ' VAL . . . . . 0.791 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -132.42 129.88 59.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.0 179.463 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.3 m -92.31 124.29 36.26 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.661 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 1.097 HG23 HG23 ' B' ' 401' ' ' ILE . 24.2 m -128.3 158.01 40.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.161 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.544 ' HB2' HG22 ' B' ' 401' ' ' ILE . 4.0 tptp 85.82 23.34 0.08 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.67 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.523 ' C ' ' O ' ' B' ' 391' ' ' LYS . 64.2 mmtt -1.29 119.63 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.693 0 O-C-N 124.104 0.877 . . . . 0.0 112.475 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.492 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 17.8 Cg_exo -63.1 159.9 36.72 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.565 2.177 . . . . 0.0 113.077 -179.482 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 394' ' ' THR . . . . . 0.487 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 3.1 p -151.79 167.84 26.96 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.621 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -84.67 10.83 10.2 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.161 0.505 . . . . 0.0 110.73 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 396' ' ' VAL . . . . . 0.449 ' O ' ' CB ' ' B' ' 397' ' ' ASP . 13.8 m -130.42 17.37 2.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 108.841 -0.799 . . . . 0.0 108.841 178.148 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 397' ' ' ASP . . . . . 0.449 ' CB ' ' O ' ' B' ' 396' ' ' VAL . 0.5 OUTLIER 159.47 58.73 0.0 OUTLIER Pre-proline 0 N--CA 1.451 -0.387 0 CA-C-N 114.578 -1.192 . . . . 0.0 109.184 -179.322 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.492 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 0.9 OUTLIER -42.93 -52.02 5.01 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 123.65 2.9 . . . . 0.0 112.285 -179.769 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.533 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 13.6 p30 -24.54 134.08 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.827 -179.431 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 38.9 t -138.81 151.05 46.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.984 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 1.097 HG23 HG23 ' B' ' 390' ' ' VAL . 0.3 OUTLIER -109.72 142.94 20.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.037 -179.946 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.863 HG21 ' O ' ' B' ' 423' ' ' ALA . 1.6 t -108.26 160.83 7.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.6 -179.097 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 0.791 ' CB ' HG23 ' B' ' 388' ' ' VAL . 2.4 mt-10 -131.37 116.28 17.35 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.725 179.166 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.584 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -102.11 107.05 18.01 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.358 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.547 ' HA ' ' O ' ' B' ' 410' ' ' THR . 22.9 ptt180 -144.2 165.21 28.5 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.671 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.778 HG12 ' HG ' ' B' ' 385' ' ' LEU . 1.3 m -147.47 160.34 8.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.102 -179.036 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 65.84 2.71 13.09 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.905 -0.664 . . . . 0.0 113.414 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 7.3 t0 72.32 13.79 5.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.928 0.364 . . . . 0.0 111.16 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -157.43 14.63 0.3 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.243 -0.98 . . . . 0.0 113.488 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.547 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 2.5 m -133.83 121.4 21.74 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 117.057 0.429 . . . . 0.0 111.478 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 19.1 t -106.47 102.83 14.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.61 0.243 . . . . 0.0 110.41 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.774 HD13 ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -61.24 -25.33 67.0 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.838 -0.431 . . . . 0.0 109.838 179.422 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 413' ' ' GLY . . . . . 0.418 ' C ' ' SG ' ' B' ' 404' ' ' CYS . . . 164.61 -163.7 36.39 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.401 -0.904 . . . . 0.0 112.56 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.441 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 3.5 t -160.34 159.75 31.58 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.982 0.42 . . . . 0.0 111.4 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.522 ' CA ' ' HD2' ' B' ' 426' ' ' ARG . . . -152.01 165.0 30.61 Favored Glycine 0 C--O 1.225 -0.443 0 C-N-CA 120.173 -1.013 . . . . 0.0 114.111 -179.144 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 416' ' ' VAL . . . . . 0.685 HG23 ' HB ' ' B' ' 401' ' ' ILE . 0.8 OUTLIER -152.76 144.91 15.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.396 -0.402 . . . . 0.0 111.412 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 1.021 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -155.98 177.16 33.2 Favored Glycine 0 C--N 1.329 0.187 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.133 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.467 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 9.2 ptm180 -88.23 -43.26 11.72 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.848 0.324 . . . . 0.0 111.72 -179.7 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.71 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.2 OUTLIER -99.25 34.18 2.23 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 179.719 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.744 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 48.85 -45.04 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 178.509 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.653 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.7 OUTLIER -42.72 -56.04 3.34 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 -179.817 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 1.021 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -47.66 -24.94 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 CA-C-O 121.476 0.655 . . . . 0.0 109.513 178.32 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.863 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -76.48 -49.57 16.22 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.838 -1.074 . . . . 0.0 108.108 176.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 424' ' ' GLY . . . . . 0.489 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -63.92 -52.57 44.02 Favored Glycine 0 N--CA 1.448 -0.519 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.247 179.618 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.8 HG23 ' HA ' ' B' ' 367' ' ' ASP . 1.5 mm -64.65 -69.27 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.742 0.306 . . . . 0.0 110.531 179.155 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.544 ' HB3' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -47.37 -25.53 1.04 Allowed 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.278 -178.9 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.737 ' HB2' ' O ' ' B' ' 423' ' ' ALA . . . -60.7 -59.09 5.93 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 107.675 -1.232 . . . . 0.0 107.675 176.736 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 0.859 ' O ' HD13 ' B' ' 432' ' ' LEU . . . -52.92 -48.73 67.03 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 177.23 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.66 ' HA ' HD21 ' B' ' 432' ' ' LEU . 1.9 tt0 -52.94 -17.84 1.64 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.732 178.757 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 10.4 m120 -85.25 -35.78 21.35 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.047 178.681 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.509 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -67.32 -36.31 81.2 Favored 'General case' 0 N--CA 1.461 0.116 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.733 -179.271 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.878 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -94.01 12.2 27.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.805 179.58 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -87.04 -12.61 46.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.25 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 434' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -112.47 93.55 4.49 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.881 0.372 . . . . 0.0 111.4 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.556 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 8.9 ptmm? -57.37 -50.78 71.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.38 179.516 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.556 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -51.73 -45.39 63.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.637 179.896 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.608 ' SD ' HD12 ' B' ' 412' ' ' LEU . 1.2 ttp -72.81 -46.69 51.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.113 0.482 . . . . 0.0 110.238 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.878 HD11 ' HA ' ' B' ' 432' ' ' LEU . 62.1 mt -53.98 -60.44 3.33 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.672 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 439' ' ' ASP . . . . . 0.415 ' O ' ' N ' ' B' ' 442' ' ' ALA . 22.4 t70 -54.43 -44.3 72.32 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.515 179.19 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.493 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -43.49 -45.07 6.29 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.609 -0.885 . . . . 0.0 108.609 179.424 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.423 ' O ' ' C ' ' B' ' 442' ' ' ALA . 51.7 m-85 -64.65 -43.17 94.5 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.331 179.039 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 442' ' ' ALA . . . . . 0.456 ' O ' ' N ' ' B' ' 445' ' ' ARG . . . -42.32 -61.79 1.11 Allowed 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 178.415 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -48.86 -45.7 41.26 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.672 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.416 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 1.2 mt-30 -65.19 -7.72 14.07 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.942 178.898 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.549 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -89.54 -44.18 10.29 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.374 179.441 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -82.37 -33.03 28.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.571 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.31 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.921 179.961 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 366' ' ' LEU . . . . . 0.684 HD23 ' OD1' ' B' ' 369' ' ' ASN . 14.9 tp . . . . . 0 C--O 1.233 0.19 0 CA-C-O 120.994 0.426 . . . . 0.0 111.219 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.518 ' CG ' HD12 ' B' ' 425' ' ' ILE . 21.5 t0 -58.29 -64.92 0.75 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.179 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.498 ' HA ' ' CE ' ' B' ' 371' ' ' LYS . 1.5 ttp -35.82 -44.05 0.33 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.615 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 369' ' ' ASN . . . . . 0.684 ' OD1' HD23 ' B' ' 366' ' ' LEU . 3.0 m120 -60.99 -47.91 84.28 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.571 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 1.076 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -58.94 -70.59 0.14 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.626 179.503 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.498 ' CE ' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -36.22 -49.48 0.68 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.814 179.924 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.557 ' O ' ' CB ' ' B' ' 376' ' ' SER . 1.6 tmm_? -55.42 -38.44 68.98 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.508 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.547 ' O ' ' HB2' ' B' ' 377' ' ' LEU . 0.3 OUTLIER -65.58 -62.61 1.42 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.598 0.713 . . . . 0.0 110.425 179.175 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 0.67 HD13 ' OH ' ' B' ' 387' ' ' TYR . 1.0 OUTLIER -43.2 -70.77 0.1 Allowed 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -178.959 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -93.04 -20.83 20.16 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 -176.353 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.557 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.6 OUTLIER -94.45 1.6 55.76 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 119.91 -0.716 . . . . 0.0 111.1 -179.525 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.547 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 0.3 OUTLIER -134.68 -37.83 0.83 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.663 178.218 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.488 HG23 ' CB ' ' B' ' 441' ' ' TYR . 0.8 OUTLIER -127.76 -149.33 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.898 179.284 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.485 ' H ' HG22 ' B' ' 378' ' ' ILE . . . 28.74 74.24 0.03 OUTLIER Glycine 0 C--N 1.332 0.338 0 C-N-CA 121.35 -0.452 . . . . 0.0 113.506 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.68 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 13.7 p90 -100.12 -50.76 3.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.697 0.248 . . . . 0.0 111.176 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 381' ' ' ALA . . . . . 0.68 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 158.98 66.03 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.957 0.408 . . . . 0.0 111.079 179.753 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 382' ' ' SER . . . . . 0.57 ' HB2' ' CZ ' ' B' ' 380' ' ' TYR . 7.0 t -171.91 -72.18 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.795 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.465 HD21 ' HA2' ' B' ' 379' ' ' GLY . 2.6 pt? -49.22 -26.41 2.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.248 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 384' ' ' ARG . . . . . 0.475 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 7.1 tpt180 68.56 70.87 0.29 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.101 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.695 ' HG ' HG12 ' B' ' 406' ' ' VAL . 10.5 tt -89.18 121.98 32.02 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 179.118 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 386' ' ' HIS . . . . . 0.585 ' CE1' ' HG2' ' B' ' 405' ' ' ARG . 4.5 p80 -141.57 145.87 35.61 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.401 0.62 . . . . 0.0 112.584 -179.025 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.67 ' OH ' HD13 ' B' ' 374' ' ' LEU . 28.7 m-85 -99.43 151.85 20.64 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.363 178.156 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 388' ' ' VAL . . . . . 1.006 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -129.82 120.35 49.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.345 179.114 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.9 m -87.06 119.11 26.93 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.257 -179.06 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 0.998 HG23 HG23 ' B' ' 401' ' ' ILE . 34.0 m -126.75 151.94 34.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.132 179.382 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.582 ' CB ' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 73.81 111.72 0.07 Allowed 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -178.834 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.425 ' HA ' ' HD3' ' B' ' 393' ' ' PRO . 21.1 mttt -96.54 133.13 25.09 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 120.93 0.395 . . . . 0.0 111.281 -179.246 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.493 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 24.3 Cg_exo -62.22 166.04 13.64 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.631 2.22 . . . . 0.0 112.393 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 394' ' ' THR . . . . . 0.487 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 64.4 p -150.64 173.88 13.63 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.459 179.178 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -85.92 15.02 5.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.192 0.52 . . . . 0.0 110.58 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 22.8 m -146.79 16.73 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.272 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 167.86 68.29 0.01 OUTLIER Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.111 -179.391 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.532 ' HB2' ' O ' ' B' ' 418' ' ' ARG . 14.2 Cg_endo -55.4 -42.86 64.04 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 123.237 2.625 . . . . 0.0 112.311 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.548 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 6.0 m-20 -20.07 124.17 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.671 -179.064 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -133.79 141.57 47.53 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.361 178.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 0.998 HG23 HG23 ' B' ' 390' ' ' VAL . 0.2 OUTLIER -114.05 138.46 43.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-O 121.269 0.557 . . . . 0.0 111.376 -179.058 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.756 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.7 OUTLIER -105.11 166.7 3.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.433 -179.879 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 1.006 ' CB ' HG23 ' B' ' 388' ' ' VAL . 1.0 OUTLIER -133.8 112.59 11.46 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.045 0.45 . . . . 0.0 110.472 179.326 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.423 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -94.51 108.61 20.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.506 179.186 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.585 ' HG2' ' CE1' ' B' ' 386' ' ' HIS . 0.2 OUTLIER -150.3 169.28 21.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.151 0.501 . . . . 0.0 111.413 -179.439 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.695 HG12 ' HG ' ' B' ' 385' ' ' LEU . 1.2 m -144.59 145.21 21.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.775 -179.57 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 67.43 2.44 20.63 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.907 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 408' ' ' ASP . . . . . 0.499 ' HA ' ' HD3' ' B' ' 405' ' ' ARG . 16.5 t70 71.14 13.69 6.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.726 0.298 . . . . 0.0 111.066 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -137.11 -6.62 1.65 Allowed Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.395 -0.907 . . . . 0.0 113.6 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.562 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 95.3 m -127.03 119.71 27.28 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 117.15 0.475 . . . . 0.0 111.547 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 411' ' ' VAL . . . . . 0.514 ' HA ' ' HB2' ' B' ' 405' ' ' ARG . 41.5 t -102.89 97.09 5.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-O 120.752 0.31 . . . . 0.0 110.75 179.432 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.757 HD13 ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -56.32 -22.48 30.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.696 -179.971 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 164.71 -165.66 37.6 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.405 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.683 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.0 OUTLIER -152.12 152.67 32.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.775 0.321 . . . . 0.0 110.732 -179.916 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.542 ' HA2' ' HG2' ' B' ' 426' ' ' ARG . . . -133.58 149.72 19.74 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 119.75 -1.214 . . . . 0.0 113.379 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 416' ' ' VAL . . . . . 0.566 HG13 ' O ' ' B' ' 416' ' ' VAL . 3.8 p -148.26 118.88 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.776 0.322 . . . . 0.0 110.544 179.293 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.654 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -133.29 164.66 24.22 Favored Glycine 0 C--O 1.226 -0.347 0 C-N-CA 120.842 -0.694 . . . . 0.0 111.395 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.532 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.5 OUTLIER -79.88 -48.1 14.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 117.465 0.632 . . . . 0.0 111.316 -179.953 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.909 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.2 OUTLIER -74.41 -23.62 58.98 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.758 -0.201 . . . . 0.0 111.096 -179.651 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.909 HG23 ' O ' ' B' ' 419' ' ' ASN . 0.9 OUTLIER 102.87 -43.61 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 C-N-CA 124.299 1.04 . . . . 0.0 109.946 -178.374 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.628 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -49.92 -54.59 18.76 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.032 -1.47 . . . . 0.0 107.032 178.605 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.706 HD11 ' H ' ' B' ' 419' ' ' ASN . 0.1 OUTLIER -53.21 -14.48 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.515 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.89 177.935 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.762 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -84.06 -49.14 9.19 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 107.22 -1.4 . . . . 0.0 107.22 176.487 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 424' ' ' GLY . . . . . 0.616 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -60.88 -54.17 39.15 Favored Glycine 0 C--N 1.336 0.534 0 N-CA-C 109.883 -1.287 . . . . 0.0 109.883 177.698 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.518 HD12 ' CG ' ' B' ' 367' ' ' ASP . 8.9 mm -53.96 -68.28 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 177.667 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.593 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 2.6 tpt180 -39.93 -28.56 0.05 Allowed 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.101 179.278 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.616 ' HB3' ' O ' ' B' ' 424' ' ' GLY . . . -64.68 -55.1 22.22 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 177.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 1.076 ' CB ' ' HB1' ' B' ' 370' ' ' ALA . . . -59.84 -55.01 39.47 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.477 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 429' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.07 -11.92 0.53 Allowed 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.794 179.285 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.502 ' ND2' ' O ' ' B' ' 426' ' ' ARG . 1.4 m-80 -92.09 -32.04 15.31 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 177.668 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.439 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -71.93 -44.9 62.88 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.027 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.856 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.4 OUTLIER -85.1 11.1 10.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.015 -179.948 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 433' ' ' ARG . . . . . 0.514 ' HG2' ' O ' ' B' ' 433' ' ' ARG . 0.0 OUTLIER -80.27 -0.1 35.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.372 179.816 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.469 ' O ' ' HG ' ' B' ' 438' ' ' LEU . 31.3 t0 -130.09 93.17 3.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.747 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.58 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -58.24 -39.7 79.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.867 -179.832 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.58 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 9.8 mtpt -57.27 -41.64 80.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.767 0.318 . . . . 0.0 110.414 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.648 ' SD ' HD12 ' B' ' 412' ' ' LEU . 33.7 ttp -74.67 -48.43 26.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.169 0.509 . . . . 0.0 109.811 179.059 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.856 HD11 ' HA ' ' B' ' 432' ' ' LEU . 94.1 mt -53.94 -64.42 0.83 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.192 178.889 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -51.95 -45.25 64.29 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.245 -0.888 . . . . 0.0 109.93 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.574 ' CE1' ' HG3' ' B' ' 444' ' ' GLN . 0.1 OUTLIER -45.2 -38.59 5.48 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 179.561 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.548 ' CE1' ' CE2' ' B' ' 440' ' ' PHE . 25.6 m-85 -74.44 -39.64 62.44 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.061 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -52.15 -60.52 3.11 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 178.461 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 8.7 tttp -50.7 -44.4 57.98 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.206 -0.665 . . . . 0.0 109.206 178.511 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.574 ' HG3' ' CE1' ' B' ' 440' ' ' PHE . 0.5 OUTLIER -55.18 -50.75 68.57 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.028 178.787 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.615 ' HD2' ' CD1' ' B' ' 380' ' ' TYR . 7.8 mmp_? -51.69 -36.65 47.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.793 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -75.19 -41.14 58.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.956 0.408 . . . . 0.0 110.442 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.288 179.905 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 366' ' ' LEU . . . . . 0.463 ' HB3' ' HB2' ' B' ' 369' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.181 0 CA-C-O 120.886 0.374 . . . . 0.0 111.223 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.523 ' CB ' HG13 ' B' ' 425' ' ' ILE . 0.0 OUTLIER -55.42 -71.08 0.09 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.601 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.434 ' HE3' ' HB3' ' B' ' 368' ' ' MET . 3.3 tmm? -35.72 -43.79 0.3 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.999 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 369' ' ' ASN . . . . . 0.463 ' HB2' ' HB3' ' B' ' 366' ' ' LEU . 87.1 m-20 -65.31 -42.9 92.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.896 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 0.806 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -62.76 -71.94 0.15 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.448 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.462 ' HD3' ' O ' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -35.82 -49.45 0.61 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.968 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.572 ' O ' ' CB ' ' B' ' 376' ' ' SER . 3.5 tmm_? -58.39 -37.03 74.45 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.924 0.393 . . . . 0.0 110.71 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.548 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -62.34 -48.61 79.05 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.219 0.533 . . . . 0.0 110.973 179.259 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 0.925 HD13 ' OH ' ' B' ' 387' ' ' TYR . 0.4 OUTLIER -62.42 -69.06 0.28 Allowed 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -178.127 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -70.83 -40.2 72.56 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -177.535 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.572 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.5 OUTLIER -71.9 -51.63 21.24 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.227 0.455 . . . . 0.0 112.227 -178.642 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.624 ' O ' HD13 ' B' ' 378' ' ' ILE . 2.3 mm? -89.32 -23.25 22.31 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 114.733 1.383 . . . . 0.0 114.733 -176.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.624 HD13 ' O ' ' B' ' 377' ' ' LEU . 20.8 mm -127.82 -74.77 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 119.219 0.918 . . . . 0.0 113.429 -178.018 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.562 ' N ' ' O ' ' B' ' 374' ' ' LEU . . . -51.61 80.43 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.176 0 CA-C-N 116.188 -0.46 . . . . 0.0 113.433 -178.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.637 ' CE1' ' O ' ' B' ' 382' ' ' SER . 14.5 p90 -102.05 173.18 6.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.757 0.313 . . . . 0.0 111.117 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 381' ' ' ALA . . . . . 0.442 ' C ' ' O ' ' B' ' 380' ' ' TYR . . . -28.07 -43.03 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.193 -179.281 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 382' ' ' SER . . . . . 0.637 ' O ' ' CE1' ' B' ' 380' ' ' TYR . 0.5 OUTLIER -114.39 132.34 56.26 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.839 -179.945 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.971 HD11 ' HB2' ' B' ' 385' ' ' LEU . 0.1 OUTLIER 151.31 -49.74 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.936 0.398 . . . . 0.0 110.479 -179.871 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 384' ' ' ARG . . . . . 0.743 ' N ' HD13 ' B' ' 383' ' ' LEU . 0.0 OUTLIER 69.88 73.75 0.23 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.064 178.708 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.971 ' HB2' HD11 ' B' ' 383' ' ' LEU . 6.0 tt -102.71 128.8 49.27 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 179.107 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 386' ' ' HIS . . . . . 0.478 ' O ' ' O ' ' B' ' 405' ' ' ARG . 14.9 p-80 -141.32 144.96 34.88 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.48 0.657 . . . . 0.0 112.761 -179.038 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.925 ' OH ' HD13 ' B' ' 374' ' ' LEU . 27.4 m-85 -103.06 145.93 29.15 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.748 178.633 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 388' ' ' VAL . . . . . 0.739 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -129.08 122.23 55.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.128 179.211 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.7 m -85.5 122.52 29.75 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.555 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 0.574 HG23 ' CG2' ' B' ' 401' ' ' ILE . 35.7 m -130.25 154.28 40.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.549 -179.808 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.555 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 9.0 tptt 95.07 23.01 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.326 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.532 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER 3.62 114.11 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.696 0 O-C-N 123.979 0.799 . . . . 0.0 112.192 179.931 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.47 ' HG3' ' HB2' ' B' ' 400' ' ' SER . 34.5 Cg_exo -55.2 163.64 4.41 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.525 2.15 . . . . 0.0 113.226 -179.17 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 394' ' ' THR . . . . . 0.473 ' CG2' ' OD1' ' B' ' 397' ' ' ASP . 0.1 OUTLIER -131.33 177.22 7.64 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.706 -1.133 . . . . 0.0 111.738 -179.288 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -102.08 18.0 21.87 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.565 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 396' ' ' VAL . . . . . 0.499 ' O ' ' HB3' ' B' ' 397' ' ' ASP . 10.1 m -137.4 6.57 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.984 178.262 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 397' ' ' ASP . . . . . 0.499 ' HB3' ' O ' ' B' ' 396' ' ' VAL . 17.8 p-10 172.79 54.17 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.384 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.464 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 93.1 Cg_exo -33.34 -29.18 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.613 2.875 . . . . 0.0 113.566 -179.161 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.559 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 1.1 p-10 -31.65 125.41 0.24 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.189 0.519 . . . . 0.0 111.854 -178.905 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 400' ' ' SER . . . . . 0.47 ' HB2' ' HG3' ' B' ' 393' ' ' PRO . 29.1 t -133.92 157.01 47.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.914 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 0.574 ' CG2' HG23 ' B' ' 390' ' ' VAL . 4.6 tt -114.85 151.58 16.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.14 0.495 . . . . 0.0 111.037 -179.723 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.681 ' O ' HG22 ' B' ' 414' ' ' THR . 0.4 OUTLIER -116.14 158.59 16.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.14 -178.971 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 0.739 ' CB ' HG23 ' B' ' 388' ' ' VAL . 3.6 mm-40 -122.79 118.37 27.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.884 179.012 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.666 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 8.9 t -96.77 100.04 11.6 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 179.056 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.651 ' HA ' ' O ' ' B' ' 410' ' ' THR . 13.1 ttp180 -140.35 162.73 34.59 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 121.033 0.444 . . . . 0.0 111.53 -179.036 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.654 HG12 ' HG ' ' B' ' 385' ' ' LEU . 2.0 m -146.5 -178.54 0.71 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.44 -179.328 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 58.86 -101.48 0.22 Allowed Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.914 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -156.95 18.37 0.31 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.874 0.368 . . . . 0.0 110.965 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 165.03 37.35 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.937 -0.649 . . . . 0.0 111.942 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.651 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 17.4 m -122.96 114.73 20.82 Favored 'General case' 0 C--O 1.217 -0.644 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 411' ' ' VAL . . . . . 0.485 HG22 ' HB2' ' B' ' 405' ' ' ARG . 47.1 t -107.33 107.79 23.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.581 0.229 . . . . 0.0 111.047 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.653 HD21 HG13 ' B' ' 406' ' ' VAL . 0.6 OUTLIER -66.91 -27.87 67.85 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 179.324 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 413' ' ' GLY . . . . . 0.53 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 167.26 -168.19 40.3 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.211 -0.995 . . . . 0.0 113.004 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.681 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.0 OUTLIER -145.58 155.97 43.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.697 0.284 . . . . 0.0 111.211 -179.364 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.545 ' O ' ' CG1' ' B' ' 401' ' ' ILE . . . -148.3 151.89 24.03 Favored Glycine 0 C--O 1.223 -0.564 0 C-N-CA 120.227 -0.987 . . . . 0.0 113.22 -179.477 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 416' ' ' VAL . . . . . 0.412 ' HB ' HG13 ' B' ' 401' ' ' ILE . 3.5 p -139.12 148.86 23.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.731 0.301 . . . . 0.0 110.978 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.825 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -160.53 152.59 23.35 Favored Glycine 0 C--O 1.228 -0.24 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.16 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.422 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 0.0 OUTLIER -68.81 -44.5 73.4 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.378 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.798 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.3 OUTLIER -98.05 32.08 2.52 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.185 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.724 ' C ' HD12 ' B' ' 420' ' ' ILE . 0.4 OUTLIER 51.55 -47.43 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 178.59 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.635 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -44.91 -54.79 6.09 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -179.577 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.825 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -50.39 -19.34 0.71 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.527 0 N-CA-C 109.9 -0.408 . . . . 0.0 109.9 178.486 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.663 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -83.23 -48.37 10.55 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 177.124 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 424' ' ' GLY . . . . . 0.711 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -59.78 -52.36 53.42 Favored Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 177.666 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.523 HG13 ' CB ' ' B' ' 367' ' ' ASP . 0.5 OUTLIER -57.61 -67.17 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 177.329 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.615 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 10.8 tpt180 -39.81 -30.19 0.08 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.096 178.763 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.711 ' HB3' ' O ' ' B' ' 424' ' ' GLY . . . -60.71 -61.42 2.6 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.139 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 0.806 ' CB ' ' HB1' ' B' ' 370' ' ' ALA . . . -53.23 -49.84 66.0 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 177.525 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.589 ' HA ' HD21 ' B' ' 432' ' ' LEU . 1.4 tt0 -47.51 -24.54 0.87 Allowed 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.431 178.639 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.53 ' HB3' ' HA3' ' B' ' 413' ' ' GLY . 14.2 m120 -81.71 -34.63 30.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.65 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.666 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -69.84 -42.28 73.79 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.718 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.966 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -83.66 9.62 11.2 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.889 -0.324 . . . . 0.0 111.408 -179.507 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 433' ' ' ARG . . . . . 0.453 ' HD2' ' HA ' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -88.68 -9.75 50.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.163 -179.587 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.5 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 76.7 m-20 -108.91 83.51 1.77 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.239 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.543 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 4.6 ptmm? -50.77 -53.38 32.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.027 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.543 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 10.0 mtpp -52.48 -43.98 65.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.736 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.5 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 14.3 tmm? -70.08 -50.52 40.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.964 0.412 . . . . 0.0 110.252 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.966 HD11 ' HA ' ' B' ' 432' ' ' LEU . 85.6 mt -52.77 -61.98 1.94 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.398 179.326 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -56.42 -44.13 80.08 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.032 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.45 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -42.29 -44.73 3.95 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.908 179.641 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.46 ' O ' ' HG2' ' B' ' 445' ' ' ARG . 49.9 m-85 -67.94 -44.49 76.71 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.62 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 442' ' ' ALA . . . . . 0.409 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -44.5 -60.54 1.92 Allowed 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 178.036 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 11.2 ttmt -47.76 -38.93 16.57 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.652 -0.703 . . . . 0.0 109.219 178.359 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.635 ' HG3' ' N ' ' B' ' 445' ' ' ARG . 0.0 OUTLIER -61.3 -51.32 69.38 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 178.512 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.635 ' N ' ' HG3' ' B' ' 444' ' ' GLN . 0.3 OUTLIER -44.11 -43.95 7.26 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.993 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -80.59 -36.21 33.13 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.189 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.295 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.942 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 366' ' ' LEU . . . . . 0.491 HD12 ' HA ' ' B' ' 366' ' ' LEU . 6.1 tp . . . . . 0 CA--C 1.523 -0.078 0 CA-C-O 121.369 0.604 . . . . 0.0 110.79 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.664 ' HB3' HD12 ' B' ' 425' ' ' ILE . 0.2 OUTLIER -44.75 -75.14 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.99 179.396 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.42 ' C ' ' O ' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -36.15 -44.2 0.38 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.666 179.779 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 369' ' ' ASN . . . . . 0.472 ' HB2' ' HG ' ' B' ' 366' ' ' LEU . 7.7 m120 -66.49 -38.36 87.11 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.921 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 0.927 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -61.31 -70.45 0.19 Allowed 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.831 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.426 ' C ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -39.07 -42.17 0.88 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.061 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.559 ' O ' ' CB ' ' B' ' 376' ' ' SER . 3.0 tmt_? -53.49 -43.28 68.1 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.73 179.142 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.546 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.4 OUTLIER -64.43 -60.93 2.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.485 179.212 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 0.658 HD23 ' N ' ' B' ' 374' ' ' LEU . 0.7 OUTLIER -45.8 -74.4 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 -178.474 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -95.56 -4.7 44.21 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -176.459 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.559 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -108.84 1.15 20.7 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.044 -0.662 . . . . 0.0 110.337 179.017 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.723 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.2 OUTLIER -133.88 -40.16 0.86 Allowed 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 178.215 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.723 HD13 ' O ' ' B' ' 377' ' ' LEU . 2.1 mm -129.37 -144.88 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.609 179.353 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.479 ' H ' HG22 ' B' ' 378' ' ' ILE . . . 40.65 66.61 0.83 Allowed Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.993 -0.622 . . . . 0.0 113.701 179.026 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.676 ' O ' ' HB3' ' B' ' 381' ' ' ALA . 30.9 p90 -77.12 -4.03 42.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.802 0.301 . . . . 0.0 110.569 179.04 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 381' ' ' ALA . . . . . 0.676 ' HB3' ' O ' ' B' ' 380' ' ' TYR . . . 95.15 -38.53 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 178.736 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 382' ' ' SER . . . . . 0.443 ' HB3' ' CD2' ' B' ' 380' ' ' TYR . 11.1 t -86.59 24.9 1.33 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.172 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.646 HD12 ' CE1' ' B' ' 441' ' ' TYR . 0.4 OUTLIER -114.31 -5.8 12.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.699 0.285 . . . . 0.0 111.064 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 384' ' ' ARG . . . . . 0.501 ' O ' HG12 ' B' ' 406' ' ' VAL . 14.5 tpp180 63.68 59.14 1.2 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.994 0.426 . . . . 0.0 110.693 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.613 ' HA ' HG12 ' B' ' 406' ' ' VAL . 7.8 tt -114.43 133.11 55.97 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.907 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 386' ' ' HIS . . . . . 0.595 ' N ' HD23 ' B' ' 385' ' ' LEU . 15.5 p80 -158.85 160.73 36.51 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.631 0.729 . . . . 0.0 112.785 -179.078 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.615 ' CE2' ' HB1' ' B' ' 427' ' ' ALA . 8.0 m-85 -108.09 145.72 33.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.624 -1.171 . . . . 0.0 110.511 178.596 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 388' ' ' VAL . . . . . 0.461 HG23 ' HB2' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -127.86 125.56 65.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.536 179.108 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.6 m -86.14 123.87 31.91 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.499 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 1.009 HG23 HG23 ' B' ' 401' ' ' ILE . 19.6 m -129.89 156.97 42.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.01 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.84 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 86.49 19.9 0.08 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.036 179.868 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.509 ' C ' ' O ' ' B' ' 391' ' ' LYS . 1.3 mmmt -2.76 122.66 0.0 OUTLIER Pre-proline 0 N--CA 1.471 0.616 0 O-C-N 124.194 0.934 . . . . 0.0 112.551 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.497 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 12.4 Cg_exo -66.24 157.48 59.76 Favored 'Trans proline' 0 N--CA 1.464 -0.24 0 C-N-CA 122.695 2.263 . . . . 0.0 113.282 -179.577 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 394' ' ' THR . . . . . 0.463 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 0.3 OUTLIER -148.64 166.34 28.63 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.798 -1.092 . . . . 0.0 111.472 -179.764 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -82.69 10.13 8.16 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-O 121.089 0.471 . . . . 0.0 110.812 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 396' ' ' VAL . . . . . 0.424 HG22 ' OG1' ' B' ' 394' ' ' THR . 27.2 m -132.67 15.04 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.386 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 165.73 57.46 0.0 OUTLIER Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 114.581 -1.19 . . . . 0.0 109.335 -179.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.497 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 1.0 OUTLIER -42.95 -54.64 3.24 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 123.483 2.789 . . . . 0.0 111.715 179.981 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.531 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 6.7 m120 -19.54 130.51 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.837 -1.074 . . . . 0.0 112.002 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -140.25 150.49 44.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.898 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 1.009 HG23 HG23 ' B' ' 390' ' ' VAL . 0.5 OUTLIER -115.44 143.98 24.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.985 -179.714 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.636 HG23 ' HB1' ' B' ' 423' ' ' ALA . 1.5 t -108.65 159.62 7.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.949 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 0.461 ' HB2' HG23 ' B' ' 388' ' ' VAL . 0.9 OUTLIER -134.03 123.35 24.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.442 179.568 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.533 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.1 OUTLIER -111.08 113.04 25.27 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 179.27 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.592 ' HA ' ' O ' ' B' ' 410' ' ' THR . 3.1 ptt180 -141.26 171.73 13.67 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 123.389 0.431 . . . . 0.0 111.675 -179.0 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.668 HG23 ' HB ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -139.32 166.7 21.18 Favored 'Isoleucine or valine' 0 C--O 1.239 0.536 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.383 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 407' ' ' GLY . . . . . 0.592 ' O ' ' CB ' ' B' ' 408' ' ' ASP . . . -45.26 103.3 0.05 OUTLIER Glycine 0 C--N 1.338 0.686 0 CA-C-N 114.879 -1.055 . . . . 0.0 113.335 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 408' ' ' ASP . . . . . 0.592 ' CB ' ' O ' ' B' ' 407' ' ' GLY . 3.8 t70 137.21 -9.14 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 123.796 0.838 . . . . 0.0 109.745 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 88.81 19.04 53.14 Favored Glycine 0 N--CA 1.442 -0.904 0 N-CA-C 110.876 -0.89 . . . . 0.0 110.876 -179.237 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.668 ' HB ' HG23 ' B' ' 406' ' ' VAL . 34.7 m -82.49 125.49 31.16 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 26.8 t -103.09 110.79 30.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 120.678 0.275 . . . . 0.0 110.301 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.843 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.3 OUTLIER -64.07 -28.91 70.11 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.286 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 167.58 -169.03 40.95 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.162 -1.018 . . . . 0.0 112.749 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.529 ' OG1' HD11 ' B' ' 401' ' ' ILE . 3.5 t -156.0 148.76 24.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.909 0.385 . . . . 0.0 110.949 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.539 ' HA2' ' HG2' ' B' ' 426' ' ' ARG . . . -131.6 162.42 23.75 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.261 -0.971 . . . . 0.0 113.279 -179.569 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 416' ' ' VAL . . . . . 0.413 ' HB ' HD12 ' B' ' 401' ' ' ILE . 3.5 p -142.57 150.4 18.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.689 -0.256 . . . . 0.0 110.731 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.89 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -172.57 150.0 12.18 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.165 -1.017 . . . . 0.0 113.008 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.418 ' HA ' ' CG ' ' B' ' 399' ' ' ASN . 0.0 OUTLIER -69.73 -43.28 72.64 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.822 0.344 . . . . 0.0 111.894 -179.701 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.728 ' H ' HD11 ' B' ' 422' ' ' ILE . 6.0 t30 -97.06 29.19 3.21 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.69 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 51.38 -45.43 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 178.401 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.647 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -43.95 -54.36 5.43 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 -179.92 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.89 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -48.07 -21.04 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.057 178.551 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.69 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -83.57 -47.71 11.02 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 177.35 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 424' ' ' GLY . . . . . 0.686 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -59.63 -52.23 54.28 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 110.136 -1.186 . . . . 0.0 110.136 177.795 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.664 HD12 ' HB3' ' B' ' 367' ' ' ASP . 4.8 mm -58.46 -67.15 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 177.717 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.579 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 24.2 tpt180 -38.01 -31.31 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.186 178.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.686 ' HB3' ' O ' ' B' ' 424' ' ' GLY . . . -62.93 -57.59 10.27 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 178.434 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 0.927 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -55.76 -52.39 64.12 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.67 178.695 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.48 ' OE2' ' HB2' ' B' ' 370' ' ' ALA . 0.7 OUTLIER -56.63 -18.25 11.43 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.706 179.369 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.512 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.9 OUTLIER -79.85 -40.8 27.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.407 178.862 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.487 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -67.46 -35.03 78.39 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.376 -179.317 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.7 ' HA ' HD21 ' B' ' 438' ' ' LEU . 0.2 OUTLIER -86.98 10.96 14.77 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.682 179.786 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -85.0 -9.07 58.42 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.079 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.544 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 62.7 m-20 -115.65 80.01 1.38 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.021 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.563 ' HA ' HD12 ' B' ' 438' ' ' LEU . 7.7 ptpt -48.92 -53.03 21.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.846 0.355 . . . . 0.0 110.278 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.55 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.2 OUTLIER -53.19 -42.42 66.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.551 179.809 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.843 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.8 OUTLIER -71.12 -45.77 62.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.24 0.543 . . . . 0.0 109.598 179.085 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.7 HD21 ' HA ' ' B' ' 432' ' ' LEU . 76.9 mt -52.64 -59.88 3.93 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.461 178.637 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -56.6 -44.26 80.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.007 -0.997 . . . . 0.0 109.718 178.833 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.524 ' C ' ' CD1' ' B' ' 440' ' ' PHE . 0.2 OUTLIER -43.38 -43.95 5.41 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.564 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.646 ' CE1' HD12 ' B' ' 383' ' ' LEU . 49.7 m-85 -66.37 -46.12 77.78 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.47 179.226 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 442' ' ' ALA . . . . . 0.441 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -42.27 -60.64 1.4 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 178.605 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -49.09 -47.43 45.16 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.189 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.528 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.1 OUTLIER -52.75 -58.78 5.75 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.485 179.157 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.558 ' HG2' ' CD1' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -42.73 -38.78 2.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.68 179.504 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -74.63 -36.8 62.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.637 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 447' ' ' ALA . . . . . 0.414 ' N ' ' O ' ' B' ' 444' ' ' GLN . . . . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.446 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 366' ' ' LEU . . . . . 0.552 HD12 ' OD1' ' B' ' 369' ' ' ASN . 2.2 tp . . . . . 0 CA--C 1.527 0.091 0 CA-C-O 121.374 0.606 . . . . 0.0 111.26 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.827 ' HB3' HG23 ' B' ' 425' ' ' ILE . 0.0 OUTLIER -38.27 -72.7 0.06 Allowed 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.625 179.015 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.532 ' N ' ' HE2' ' B' ' 371' ' ' LYS . 0.3 OUTLIER -37.66 -36.88 0.19 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.052 179.813 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 369' ' ' ASN . . . . . 0.552 ' OD1' HD12 ' B' ' 366' ' ' LEU . 10.6 m120 -63.79 -43.29 96.79 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 0.799 ' HA ' HD13 ' B' ' 432' ' ' LEU . . . -60.55 -68.68 0.28 Allowed 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.72 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.532 ' HE2' ' N ' ' B' ' 368' ' ' MET . 0.1 OUTLIER -34.03 -49.39 0.35 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.711 -179.844 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.546 ' O ' ' CB ' ' B' ' 376' ' ' SER . 5.0 tmm_? -60.65 -36.59 79.05 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.922 179.833 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.637 ' NE2' ' HG ' ' B' ' 377' ' ' LEU . 1.6 tm0? -63.9 -49.81 71.21 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.88 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 0.624 HD23 ' N ' ' B' ' 374' ' ' LEU . 0.4 OUTLIER -58.51 -67.04 0.4 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.607 -178.843 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 375' ' ' TYR . . . . . 0.497 ' O ' ' HA3' ' B' ' 379' ' ' GLY . 3.3 m-85 -71.51 -50.79 27.97 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -177.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.546 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.5 OUTLIER -66.57 -53.97 28.73 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -178.789 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.637 ' HG ' ' NE2' ' B' ' 373' ' ' GLN . 0.1 OUTLIER -76.06 -38.27 57.3 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 -178.466 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.541 HD13 ' O ' ' B' ' 377' ' ' LEU . 4.8 mm -131.79 38.84 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.064 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.497 ' HA3' ' O ' ' B' ' 375' ' ' TYR . . . -121.99 63.15 0.52 Allowed Glycine 0 N--CA 1.453 -0.181 0 C-N-CA 120.372 -0.918 . . . . 0.0 112.552 179.579 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.636 ' O ' ' HB3' ' B' ' 381' ' ' ALA . 3.0 p90 -86.05 -3.23 58.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.527 0.204 . . . . 0.0 111.1 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 381' ' ' ALA . . . . . 0.636 ' HB3' ' O ' ' B' ' 380' ' ' TYR . . . 99.05 -171.05 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.592 -179.277 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 382' ' ' SER . . . . . 0.443 ' C ' ' O ' ' B' ' 381' ' ' ALA . 10.4 m 26.2 35.68 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.542 -0.754 . . . . 0.0 112.038 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.589 ' N ' ' O ' ' B' ' 381' ' ' ALA . 0.8 OUTLIER -103.21 -24.88 13.53 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.836 0.35 . . . . 0.0 110.914 -179.398 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 384' ' ' ARG . . . . . 0.497 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 3.5 tpt85 61.05 51.74 4.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.227 179.657 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.572 ' HA ' HG12 ' B' ' 406' ' ' VAL . 7.8 tt -94.87 123.99 38.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.067 179.229 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 386' ' ' HIS . . . . . 0.496 ' O ' ' O ' ' B' ' 405' ' ' ARG . 2.4 p80 -148.34 151.67 35.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.855 0.836 . . . . 0.0 113.179 -178.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.523 ' OH ' HD13 ' B' ' 374' ' ' LEU . 8.1 m-85 -105.45 156.66 17.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.724 -1.125 . . . . 0.0 110.11 178.389 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 388' ' ' VAL . . . . . 1.031 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -133.98 124.52 46.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.236 0.541 . . . . 0.0 110.847 179.588 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -85.21 119.93 26.14 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.439 -179.696 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 0.974 HG23 HG23 ' B' ' 401' ' ' ILE . 32.8 m -130.86 151.91 36.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.365 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.6 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.1 OUTLIER 85.2 16.02 0.16 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.335 179.638 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.53 ' C ' ' O ' ' B' ' 391' ' ' LYS . 22.3 mmtt -3.51 121.63 0.0 OUTLIER Pre-proline 0 N--CA 1.472 0.674 0 O-C-N 123.987 0.805 . . . . 0.0 112.348 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.482 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 25.5 Cg_exo -56.61 162.62 8.07 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.412 2.075 . . . . 0.0 112.788 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 394' ' ' THR . . . . . 0.495 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 1.1 p -156.5 168.57 26.95 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.399 -0.818 . . . . 0.0 111.73 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -81.24 8.03 9.93 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.103 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 396' ' ' VAL . . . . . 0.443 ' O ' ' HB2' ' B' ' 397' ' ' ASP . 24.2 m -132.11 14.83 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.448 0.642 . . . . 0.0 109.578 178.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 397' ' ' ASP . . . . . 0.443 ' HB2' ' O ' ' B' ' 396' ' ' VAL . 0.1 OUTLIER 166.03 58.33 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.765 -179.644 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.495 ' HA ' ' H ' ' B' ' 394' ' ' THR . 5.2 Cg_exo -39.86 -52.69 2.63 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 123.525 2.817 . . . . 0.0 112.281 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.54 ' HB3' ' HA ' ' B' ' 418' ' ' ARG . 19.2 p30 -25.11 132.14 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.323 -0.853 . . . . 0.0 112.113 -178.84 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 400' ' ' SER . . . . . 0.479 ' HB2' ' HG3' ' B' ' 393' ' ' PRO . 18.4 t -135.86 144.52 45.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.951 179.565 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 0.974 HG23 HG23 ' B' ' 390' ' ' VAL . 0.2 OUTLIER -112.27 139.46 36.85 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 CA-C-O 120.949 0.404 . . . . 0.0 110.662 -179.861 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.692 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.7 OUTLIER -100.01 161.23 3.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.773 -179.669 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 1.031 ' CB ' HG23 ' B' ' 388' ' ' VAL . 2.8 mm-40 -128.13 109.05 11.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.528 178.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.716 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 10.6 t -97.62 108.24 20.92 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.583 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.571 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -153.59 173.46 15.73 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.141 0.496 . . . . 0.0 111.532 -179.321 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.572 HG12 ' HA ' ' B' ' 385' ' ' LEU . 1.4 m -150.85 -175.84 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.989 -179.282 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 407' ' ' GLY . . . . . 0.418 ' N ' HG23 ' B' ' 406' ' ' VAL . . . 55.74 -103.85 0.27 Allowed Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.379 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -157.87 19.33 0.26 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.944 0.402 . . . . 0.0 110.883 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 173.05 25.52 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.878 -0.677 . . . . 0.0 113.145 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.571 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 24.4 m -113.17 110.3 20.19 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 117.102 0.451 . . . . 0.0 110.607 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 411' ' ' VAL . . . . . 0.456 ' HA ' ' HB3' ' B' ' 405' ' ' ARG . 10.5 t -102.33 95.48 3.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.678 0.275 . . . . 0.0 111.346 -179.712 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.624 HD13 ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -56.28 -22.34 29.54 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.933 0.397 . . . . 0.0 110.009 179.466 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 164.68 -167.38 38.45 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.485 -0.864 . . . . 0.0 112.729 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.678 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.1 OUTLIER -153.53 148.14 26.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.887 0.375 . . . . 0.0 110.872 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.524 ' HA2' ' HG2' ' B' ' 426' ' ' ARG . . . -130.91 151.24 19.55 Favored Glycine 0 C--O 1.225 -0.449 0 C-N-CA 120.187 -1.006 . . . . 0.0 113.149 -179.462 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 416' ' ' VAL . . . . . 0.78 ' HB ' HD12 ' B' ' 401' ' ' ILE . 1.9 p -152.11 126.13 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.134 0.492 . . . . 0.0 111.554 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.932 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -138.24 170.1 23.98 Favored Glycine 0 N--CA 1.449 -0.464 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.834 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.54 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 0.6 OUTLIER -83.88 -47.42 11.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.977 0.388 . . . . 0.0 111.572 -179.69 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.936 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.2 OUTLIER -80.17 -25.77 39.63 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.53 -179.579 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.936 HG23 ' O ' ' B' ' 419' ' ' ASN . 1.5 pp 112.23 -43.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 124.703 1.201 . . . . 0.0 110.138 -179.138 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.559 ' N ' HD12 ' B' ' 420' ' ' ILE . 0.3 OUTLIER -45.8 -59.15 2.96 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 179.382 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.932 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -47.63 -16.75 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.473 0 CA-C-N 114.992 -1.003 . . . . 0.0 109.862 177.685 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.741 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -87.2 -49.89 6.98 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 177.66 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.12 -44.36 94.81 Favored Glycine 0 C--N 1.338 0.68 0 C-N-CA 119.776 -1.202 . . . . 0.0 110.503 178.422 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.827 HG23 ' HB3' ' B' ' 367' ' ' ASP . 1.1 mm -68.46 -65.03 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.277 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.616 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 12.9 tpt180 -40.17 -28.51 0.06 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.026 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.506 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -75.19 -52.96 9.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.714 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 0.713 ' HB1' ' CB ' ' B' ' 370' ' ' ALA . . . -50.32 -50.5 50.68 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.411 0.624 . . . . 0.0 109.439 178.842 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 1.005 ' HA ' HD22 ' B' ' 432' ' ' LEU . 57.8 mt-10 -60.19 -60.21 4.18 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 177.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.524 ' C ' ' O ' ' B' ' 429' ' ' GLU . 3.8 m120 -24.41 -45.73 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.308 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.716 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -70.63 -54.46 11.89 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-O 121.129 0.49 . . . . 0.0 110.103 178.873 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 1.005 HD22 ' HA ' ' B' ' 429' ' ' GLU . 0.0 OUTLIER -73.7 3.12 6.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.198 178.956 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 433' ' ' ARG . . . . . 0.573 ' N ' HD23 ' B' ' 432' ' ' LEU . 0.8 OUTLIER -87.21 -8.48 56.8 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.851 -179.104 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.483 ' O ' ' HG ' ' B' ' 438' ' ' LEU . 48.0 t0 -115.84 93.05 4.09 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.784 0.326 . . . . 0.0 110.905 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.609 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 0.6 OUTLIER -61.03 -42.2 98.02 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.178 -0.464 . . . . 0.0 109.875 179.54 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.609 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 25.4 mttt -54.61 -48.28 72.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.387 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.492 ' CE ' ' HG ' ' B' ' 412' ' ' LEU . 13.1 tmm? -71.46 -50.14 34.55 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.285 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.985 HD11 ' HA ' ' B' ' 432' ' ' LEU . 74.9 mt -50.81 -60.87 2.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.43 0.633 . . . . 0.0 110.123 179.349 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 439' ' ' ASP . . . . . 0.412 ' O ' ' N ' ' B' ' 442' ' ' ALA . 11.3 t70 -59.09 -41.5 88.22 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.321 178.685 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.529 ' C ' ' CD1' ' B' ' 440' ' ' PHE . 0.0 OUTLIER -44.04 -46.56 8.5 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 179.49 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.513 ' O ' ' CG ' ' B' ' 444' ' ' GLN . 55.9 m-85 -66.96 -39.78 87.32 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.22 179.042 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 442' ' ' ALA . . . . . 0.412 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -46.98 -60.16 2.63 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 177.704 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -47.32 -40.63 17.51 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.121 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.668 ' HG3' ' N ' ' B' ' 445' ' ' ARG . 0.0 OUTLIER -58.23 -52.15 66.78 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.678 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.668 ' N ' ' HG3' ' B' ' 444' ' ' GLN . 0.4 OUTLIER -45.74 -42.18 11.58 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.744 179.813 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -71.74 -38.29 70.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.09 0.472 . . . . 0.0 110.209 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.047 179.937 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 366' ' ' LEU . . . . . . . . . . . . . 1.2 mp . . . . . 0 CA--C 1.522 -0.098 0 CA-C-O 121.056 0.455 . . . . 0.0 111.508 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.506 ' HB3' ' CG1' ' B' ' 425' ' ' ILE . 0.3 OUTLIER -54.75 -71.23 0.08 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.213 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.447 ' C ' ' O ' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -32.39 -49.36 0.2 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.931 179.805 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 57.2 m-20 -62.14 -47.42 84.64 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.685 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 1.084 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -61.64 -71.14 0.16 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.656 0.265 . . . . 0.0 110.303 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.485 ' HD2' ' HB2' ' B' ' 367' ' ' ASP . 0.2 OUTLIER -33.09 -46.46 0.16 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.038 179.849 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.554 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.0 OUTLIER -66.69 -38.31 86.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.648 -179.484 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.848 HE22 HD22 ' B' ' 438' ' ' LEU . 3.8 tm0? -61.63 -59.02 5.84 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.352 0.596 . . . . 0.0 110.639 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 0.658 HD11 ' HB3' ' B' ' 431' ' ' ALA . 2.3 mm? -58.18 -65.34 0.66 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.9 -1.046 . . . . 0.0 112.749 -178.766 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 375' ' ' TYR . . . . . 0.541 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 63.2 m-85 -73.64 -42.37 61.5 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -177.351 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.554 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -78.36 -52.9 7.9 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.503 -0.479 . . . . 0.0 111.671 -179.267 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.607 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.6 OUTLIER -76.32 -31.28 58.08 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -178.376 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.607 HD13 ' O ' ' B' ' 377' ' ' LEU . 4.3 mm -141.56 39.12 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.81 -179.02 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.541 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -115.34 94.24 0.65 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.351 -0.928 . . . . 0.0 113.338 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.773 ' CE1' HD12 ' B' ' 383' ' ' LEU . 0.4 OUTLIER -145.77 -178.11 5.94 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.278 -0.268 . . . . 0.0 110.278 179.448 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -91.76 75.92 5.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.9 0.381 . . . . 0.0 111.373 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 382' ' ' SER . . . . . 0.588 ' HB2' ' CE2' ' B' ' 380' ' ' TYR . 0.7 OUTLIER -170.31 -68.68 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.864 179.686 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.852 HD22 ' N ' ' B' ' 384' ' ' ARG . 0.0 OUTLIER -51.12 -41.4 60.03 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.183 -0.302 . . . . 0.0 110.183 179.612 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 384' ' ' ARG . . . . . 0.852 ' N ' HD22 ' B' ' 383' ' ' LEU . 2.1 tpt85 72.78 89.41 0.09 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 178.804 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.75 ' HA ' HG12 ' B' ' 406' ' ' VAL . 0.1 OUTLIER -63.89 147.08 52.77 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.647 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 386' ' ' HIS . . . . . 0.538 ' CB ' ' O ' ' B' ' 405' ' ' ARG . 0.1 OUTLIER -147.94 70.18 1.14 Allowed 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -178.943 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.583 ' CE2' ' HB1' ' B' ' 427' ' ' ALA . 4.0 m-85 -91.59 113.65 25.97 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.383 177.875 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 388' ' ' VAL . . . . . 0.465 HG23 ' HB3' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -109.28 133.11 55.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.735 0.302 . . . . 0.0 110.706 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 5.3 m -87.76 125.35 34.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.0 0.429 . . . . 0.0 110.536 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 0.926 HG23 HG23 ' B' ' 401' ' ' ILE . 27.1 m -131.38 159.68 42.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.582 -179.602 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.828 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 88.4 23.48 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.45 179.41 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.519 ' O ' ' O ' ' B' ' 391' ' ' LYS . 9.6 mmtt 1.78 118.28 0.0 OUTLIER Pre-proline 0 N--CA 1.472 0.673 0 O-C-N 124.249 0.968 . . . . 0.0 112.476 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.467 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 22.8 Cg_exo -61.01 162.59 18.78 Favored 'Trans proline' 0 N--CA 1.463 -0.272 0 C-N-CA 122.677 2.251 . . . . 0.0 113.153 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 394' ' ' THR . . . . . 0.439 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 2.9 p -127.82 170.46 12.76 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.768 -1.106 . . . . 0.0 111.194 -179.709 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -97.09 19.64 12.59 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.227 0.537 . . . . 0.0 110.905 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 31.5 m -137.5 8.24 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.946 178.265 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 397' ' ' ASP . . . . . 0.495 ' O ' ' N ' ' B' ' 399' ' ' ASN . 1.2 m-20 164.91 62.47 0.0 OUTLIER Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 114.82 -1.082 . . . . 0.0 108.929 -179.289 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.546 ' HB2' ' O ' ' B' ' 418' ' ' ARG . 47.2 Cg_exo -34.04 -25.78 0.03 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 123.882 3.055 . . . . 0.0 113.943 -179.079 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.535 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 23.0 m120 -16.19 122.04 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 179.645 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -143.61 151.72 40.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.014 0.435 . . . . 0.0 111.303 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 0.926 HG23 HG23 ' B' ' 390' ' ' VAL . 0.7 OUTLIER -116.8 144.95 23.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.188 -179.591 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.664 ' O ' HG22 ' B' ' 414' ' ' THR . 0.2 OUTLIER -110.25 150.22 12.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.294 -179.714 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 0.475 ' O ' ' HA ' ' B' ' 387' ' ' TYR . 0.1 OUTLIER -109.43 103.7 12.65 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-O 120.922 0.392 . . . . 0.0 109.965 178.967 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.47 ' SG ' ' O ' ' B' ' 413' ' ' GLY . 0.0 OUTLIER -81.4 91.2 6.25 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 179.296 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.563 ' CG ' ' O ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -133.97 152.27 51.79 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.202 -179.046 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.75 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.9 OUTLIER -126.41 -174.5 1.08 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.507 0 CA-C-O 120.852 0.358 . . . . 0.0 111.202 -179.735 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 57.33 -94.4 0.04 OUTLIER Glycine 0 C--N 1.335 0.495 0 C-N-CA 120.791 -0.719 . . . . 0.0 111.872 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -164.45 26.51 0.07 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.019 0.438 . . . . 0.0 109.843 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 168.35 -16.48 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.526 -0.845 . . . . 0.0 113.146 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.563 ' O ' ' CG ' ' B' ' 405' ' ' ARG . 56.5 m -70.17 133.6 47.26 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 179.137 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 411' ' ' VAL . . . . . 0.602 HG12 ' N ' ' B' ' 412' ' ' LEU . 39.2 t -85.04 -115.15 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 C-N-CA 120.22 -0.592 . . . . 0.0 112.012 -178.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.602 ' N ' HG12 ' B' ' 411' ' ' VAL . 0.0 OUTLIER 138.24 -45.85 0.01 OUTLIER 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 -178.357 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 413' ' ' GLY . . . . . 0.477 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 173.38 -176.45 46.04 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 114.97 -1.014 . . . . 0.0 112.564 179.442 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.664 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.2 OUTLIER -144.04 155.26 43.92 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.749 -0.226 . . . . 0.0 110.731 -179.719 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.486 ' CA ' ' HG3' ' B' ' 426' ' ' ARG . . . -146.18 140.96 9.19 Favored Glycine 0 C--O 1.226 -0.365 0 C-N-CA 120.063 -1.065 . . . . 0.0 112.853 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 416' ' ' VAL . . . . . 0.425 ' HB ' HD12 ' B' ' 401' ' ' ILE . 9.4 p -130.94 152.35 37.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.55 0.214 . . . . 0.0 110.474 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.863 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -164.45 155.29 26.6 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.589 -0.815 . . . . 0.0 112.48 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.546 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 1.5 ptm180 -64.2 -44.05 93.15 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.452 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.775 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.6 OUTLIER -102.4 31.58 3.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.584 0.23 . . . . 0.0 110.412 179.304 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.743 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 54.28 -45.39 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 N-CA-C 114.676 1.361 . . . . 0.0 114.676 178.752 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.785 ' HG2' HD13 ' B' ' 425' ' ' ILE . 0.0 OUTLIER -44.41 -57.24 3.66 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.863 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -47.87 -24.27 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.328 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.743 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -79.62 -48.46 13.71 Favored 'General case' 0 N--CA 1.439 -1.017 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 177.05 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 424' ' ' GLY . . . . . 0.66 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -59.17 -50.33 68.9 Favored Glycine 0 N--CA 1.449 -0.477 0 N-CA-C 110.165 -1.174 . . . . 0.0 110.165 178.116 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.785 HD13 ' HG2' ' B' ' 421' ' ' LYS . 1.2 mp -59.47 -66.82 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 177.457 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.58 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 10.4 tpt180 -38.07 -31.87 0.06 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.091 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.66 ' HB3' ' O ' ' B' ' 424' ' ' GLY . . . -62.92 -62.39 1.75 Allowed 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.509 178.625 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 1.084 ' CB ' ' HB1' ' B' ' 370' ' ' ALA . . . -53.49 -50.26 65.74 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.462 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.6 ' O ' HD22 ' B' ' 432' ' ' LEU . 0.6 OUTLIER -56.03 -18.87 10.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.76 179.235 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.516 ' ND2' ' O ' ' B' ' 414' ' ' THR . 0.8 OUTLIER -81.34 -38.72 26.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.57 -0.287 . . . . 0.0 110.808 179.644 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.658 ' HB3' HD11 ' B' ' 374' ' ' LEU . . . -72.91 -33.42 65.98 Favored 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -178.246 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.877 ' C ' HD23 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -81.76 8.84 9.07 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.887 0.375 . . . . 0.0 111.527 -179.443 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 433' ' ' ARG . . . . . 0.684 ' N ' HD23 ' B' ' 432' ' ' LEU . 1.3 mtm180 -85.6 -3.91 59.01 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.939 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 434' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -115.25 79.55 1.3 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.386 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.542 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -48.0 -54.27 13.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.719 0.295 . . . . 0.0 111.071 -179.799 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.542 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 13.7 mtpp -55.2 -40.9 71.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.84 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.472 ' O ' ' HB3' ' B' ' 440' ' ' PHE . 17.5 tmm? -69.48 -52.97 21.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.993 0.425 . . . . 0.0 110.139 179.282 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.848 HD22 HE22 ' B' ' 373' ' ' GLN . 74.3 mt -50.73 -61.9 1.92 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.544 0.688 . . . . 0.0 110.329 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -49.43 -48.16 47.57 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.922 -1.035 . . . . 0.0 109.543 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.515 ' C ' ' CD1' ' B' ' 440' ' ' PHE . 0.1 OUTLIER -43.75 -42.67 5.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.484 179.743 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.622 ' CE2' ' HB2' ' B' ' 383' ' ' LEU . 36.8 m-85 -69.88 -36.74 75.69 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.094 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -51.34 -60.73 2.8 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 178.248 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 443' ' ' LYS . . . . . 0.424 ' C ' ' CD ' ' B' ' 443' ' ' LYS . 0.0 OUTLIER -48.08 -43.21 30.42 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.064 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.542 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 1.0 OUTLIER -55.38 -55.83 27.07 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.262 178.954 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.596 ' HD2' ' CD2' ' B' ' 380' ' ' TYR . 0.2 OUTLIER -44.39 -36.98 3.1 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.347 179.582 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -81.43 -36.37 29.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.642 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.238 -179.663 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 366' ' ' LEU . . . . . 0.526 ' O ' ' HB2' ' B' ' 369' ' ' ASN . 3.7 tp . . . . . 0 CA--C 1.522 -0.125 0 CA-C-O 120.74 0.305 . . . . 0.0 111.54 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.546 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.1 OUTLIER -36.7 -77.11 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.917 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.548 ' CE ' ' N ' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -36.05 -41.28 0.24 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.988 178.994 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 369' ' ' ASN . . . . . 0.548 ' N ' ' CE ' ' B' ' 368' ' ' MET . 0.6 OUTLIER -61.8 -44.44 96.85 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.409 179.181 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 0.756 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -56.89 -68.46 0.22 Allowed 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.632 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.5 ' CE ' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -34.56 -47.93 0.34 Allowed 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.029 0.442 . . . . 0.0 110.35 -179.919 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.591 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.0 OUTLIER -56.57 -39.78 74.07 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.008 179.654 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.924 ' OE1' HD23 ' B' ' 377' ' ' LEU . 0.8 OUTLIER -63.62 -60.29 3.51 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.581 0.705 . . . . 0.0 110.751 179.31 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 0.936 HD11 ' HB2' ' B' ' 428' ' ' ALA . 0.2 OUTLIER -49.19 -72.47 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.114 -0.948 . . . . 0.0 113.428 -178.424 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -89.01 -2.99 58.84 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -176.496 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.591 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -119.04 5.73 11.32 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 119.915 -0.714 . . . . 0.0 111.415 179.811 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.924 HD23 ' OE1' ' B' ' 373' ' ' GLN . 9.9 tp -144.11 -32.91 0.42 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.493 179.215 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.527 ' CG1' ' OE1' ' B' ' 373' ' ' GLN . 3.8 mm -134.58 37.15 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 120.836 0.35 . . . . 0.0 111.378 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 379' ' ' GLY . . . . . . . . . . . . . . . -120.75 93.02 0.52 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.623 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.616 ' CZ ' ' HG ' ' B' ' 383' ' ' LEU . 0.1 OUTLIER -126.93 -98.58 0.39 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.519 0.199 . . . . 0.0 110.985 179.633 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -155.58 -41.42 0.08 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.737 0.303 . . . . 0.0 111.426 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.26 -51.1 69.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.912 0.387 . . . . 0.0 110.645 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.871 HD22 ' O ' ' B' ' 383' ' ' LEU . 0.0 OUTLIER -92.13 37.43 0.98 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.873 179.843 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 384' ' ' ARG . . . . . 0.495 ' CG ' ' O ' ' B' ' 384' ' ' ARG . 2.0 ptm180 -26.21 97.7 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.921 -179.632 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.725 HD22 ' HE1' ' B' ' 387' ' ' TYR . 0.3 OUTLIER -59.89 163.04 4.88 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.955 179.374 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 386' ' ' HIS . . . . . 0.488 ' CB ' ' O ' ' B' ' 405' ' ' ARG . 0.0 OUTLIER -160.27 83.71 0.71 Allowed 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -179.188 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.725 ' HE1' HD22 ' B' ' 385' ' ' LEU . 60.4 m-85 -87.77 114.91 24.83 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 177.419 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 388' ' ' VAL . . . . . 0.49 HG23 ' HB3' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -123.9 115.48 45.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.494 -0.483 . . . . 0.0 112.302 -179.372 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 389' ' ' THR . . . . . 0.574 HG23 ' OG ' ' B' ' 400' ' ' SER . 3.9 m -70.37 128.86 37.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.543 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 0.75 HG23 HG23 ' B' ' 401' ' ' ILE . 19.9 m -132.71 159.89 42.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.6 -179.385 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.54 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 92.68 36.85 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.771 179.743 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.51 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER 0.94 117.82 0.0 OUTLIER Pre-proline 0 N--CA 1.472 0.634 0 O-C-N 124.038 0.836 . . . . 0.0 112.704 179.596 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.519 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 26.4 Cg_exo -60.37 163.76 14.3 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.669 2.246 . . . . 0.0 113.249 -179.688 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 394' ' ' THR . . . . . 0.452 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 18.2 p -135.43 172.42 13.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.055 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -98.05 18.36 16.24 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 121.174 0.512 . . . . 0.0 110.472 179.642 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 11.4 m -125.47 -0.85 5.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.967 178.414 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 397' ' ' ASP . . . . . 0.528 ' O ' ' N ' ' B' ' 399' ' ' ASN . 11.6 m-20 170.61 54.47 0.01 OUTLIER Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 114.625 -1.17 . . . . 0.0 108.599 -179.464 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.519 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 76.8 Cg_exo -29.56 -32.36 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 124.089 3.193 . . . . 0.0 113.517 -178.912 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.55 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 6.5 p30 -25.45 142.06 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.863 -178.719 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 400' ' ' SER . . . . . 0.574 ' OG ' HG23 ' B' ' 389' ' ' THR . 1.0 OUTLIER -140.79 158.07 44.49 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.643 -179.222 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 1.082 HD12 HG23 ' B' ' 416' ' ' VAL . 0.2 OUTLIER -110.48 144.49 18.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.432 -0.803 . . . . 0.0 111.303 -179.399 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.884 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.3 OUTLIER -109.7 146.21 15.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.777 -179.202 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 0.49 ' HB3' HG23 ' B' ' 388' ' ' VAL . 6.0 tt0 -111.79 95.95 5.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.073 179.093 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.496 ' SG ' ' CZ ' ' B' ' 387' ' ' TYR . 4.6 t -75.89 87.1 2.86 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.347 -0.842 . . . . 0.0 108.873 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.574 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -133.17 152.83 51.93 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.109 -179.205 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.85 HG22 ' HB ' ' B' ' 410' ' ' THR . 0.9 OUTLIER -145.94 151.27 14.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.714 -179.103 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 67.79 -103.91 1.06 Allowed Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.736 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -149.68 2.76 0.54 Allowed 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -166.37 22.61 0.12 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 119.896 -1.145 . . . . 0.0 113.18 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.903 HG21 ' OH ' ' B' ' 441' ' ' TYR . 0.2 OUTLIER -116.31 97.61 6.13 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 117.116 0.458 . . . . 0.0 110.926 179.536 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 411' ' ' VAL . . . . . 0.776 ' O ' HG12 ' B' ' 411' ' ' VAL . 56.1 t -106.36 64.92 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.705 179.18 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.841 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.1 OUTLIER -30.66 -35.33 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 120.676 0.274 . . . . 0.0 110.907 -179.56 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 413' ' ' GLY . . . . . 0.544 ' N ' ' O ' ' B' ' 411' ' ' VAL . . . 165.97 -157.38 29.82 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 119.721 -1.228 . . . . 0.0 113.494 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.5 ' O ' ' ND2' ' B' ' 430' ' ' ASN . 1.1 t -153.89 174.05 15.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.27 -0.465 . . . . 0.0 111.803 -178.634 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.762 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -158.02 139.76 6.56 Favored Glycine 0 C--O 1.222 -0.641 0 C-N-CA 120.298 -0.953 . . . . 0.0 113.123 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 416' ' ' VAL . . . . . 1.082 HG23 HD12 ' B' ' 401' ' ' ILE . 41.5 t -126.13 149.92 31.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 179.118 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.96 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -163.0 162.16 34.46 Favored Glycine 0 C--O 1.225 -0.407 0 C-N-CA 120.126 -1.035 . . . . 0.0 112.465 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.487 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 1.6 ptt180 -76.95 -41.87 41.45 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.707 0.254 . . . . 0.0 111.684 -179.751 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.789 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.2 OUTLIER -101.65 27.59 6.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.034 0.445 . . . . 0.0 109.824 179.009 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.687 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 55.75 -44.76 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 178.485 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.678 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.2 OUTLIER -43.49 -58.92 2.37 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 179.565 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.96 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -45.82 -26.23 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.667 178.658 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.884 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -77.51 -47.66 19.0 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 177.224 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 424' ' ' GLY . . . . . 0.586 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -63.6 -55.67 23.84 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.732 178.779 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.538 ' CG1' ' HB3' ' B' ' 367' ' ' ASP . 0.9 OUTLIER -58.25 -71.71 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 178.621 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.555 ' HB3' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -44.16 -26.19 0.29 Allowed 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.699 -178.743 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.592 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -61.62 -54.48 42.37 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 176.809 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 0.936 ' HB2' HD11 ' B' ' 374' ' ' LEU . . . -53.47 -49.49 67.34 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 107.964 -1.125 . . . . 0.0 107.964 177.444 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.817 ' HA ' HD22 ' B' ' 432' ' ' LEU . 49.7 mt-10 -53.99 -21.97 9.38 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.365 178.957 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.592 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.7 OUTLIER -75.73 -37.28 59.54 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 178.341 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.462 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -68.49 -48.47 64.36 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.299 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.817 HD22 ' HA ' ' B' ' 429' ' ' GLU . 0.1 OUTLIER -76.91 1.31 17.99 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.117 0.484 . . . . 0.0 111.343 -179.953 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 433' ' ' ARG . . . . . 0.806 ' N ' HD23 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -71.82 -14.26 61.92 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.883 -179.92 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.523 ' HB2' ' HB3' ' B' ' 437' ' ' MET . 5.6 m-20 -120.76 86.64 2.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.927 -178.853 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.583 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 6.1 ptpp? -52.61 -52.62 54.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.983 0.421 . . . . 0.0 110.213 179.275 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.583 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 5.4 mtpp -50.63 -36.41 35.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.546 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.841 ' SD ' HD12 ' B' ' 412' ' ' LEU . 1.1 ttp -80.11 -44.76 19.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.724 179.008 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.804 HD11 ' HA ' ' B' ' 432' ' ' LEU . 87.2 mt -53.08 -63.01 1.28 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.669 0.747 . . . . 0.0 109.545 178.709 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 439' ' ' ASP . . . . . 0.405 ' O ' ' C ' ' B' ' 440' ' ' PHE . 9.1 t70 -55.57 -44.51 76.93 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.029 -0.987 . . . . 0.0 108.973 178.507 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.463 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.1 OUTLIER -41.6 -42.26 2.41 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.187 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.903 ' OH ' HG21 ' B' ' 410' ' ' THR . 46.3 m-85 -68.11 -46.45 70.87 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.232 -0.894 . . . . 0.0 110.675 179.348 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 442' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -42.82 -60.82 1.45 Allowed 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 178.701 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.67 -44.21 57.63 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.84 178.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' B' ' 441' ' ' TYR . 1.2 mt-30 -55.11 -55.38 31.7 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.06 179.278 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.555 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.1 OUTLIER -50.49 -41.56 53.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.559 -179.89 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -65.72 -46.09 80.25 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.092 0.472 . . . . 0.0 110.263 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.76 -179.315 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 366' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.457 -0.075 0 CA-C-O 120.876 0.37 . . . . 0.0 111.208 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.497 ' N ' ' OD1' ' B' ' 367' ' ' ASP . 0.1 OUTLIER -58.16 -64.96 0.73 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.941 179.363 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.471 ' HA ' ' HD2' ' B' ' 371' ' ' LYS . 1.4 ttp -33.74 -48.21 0.27 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.912 179.75 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 32.2 m-20 -61.8 -45.48 93.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.811 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 0.78 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -59.69 -69.67 0.2 Allowed 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.471 ' HD2' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -32.92 -52.74 0.34 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.977 0.418 . . . . 0.0 110.699 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 372' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -37.44 75.31 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.074 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.6 ' HA ' ' HB2' ' B' ' 377' ' ' LEU . 0.9 OUTLIER -64.09 -65.91 0.61 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.598 0.713 . . . . 0.0 110.904 179.558 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 0.828 HD12 HD11 ' B' ' 385' ' ' LEU . 4.3 mm? -48.14 -68.23 0.2 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.208 -0.906 . . . . 0.0 112.621 -179.217 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -79.4 -42.66 25.01 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 -176.785 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.47 ' O ' ' CD2' ' B' ' 377' ' ' LEU . 0.0 OUTLIER -91.54 10.46 27.83 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -177.619 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.6 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.3 OUTLIER -140.67 -38.18 0.44 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.66 0.266 . . . . 0.0 111.213 179.264 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.572 ' O ' HD13 ' B' ' 383' ' ' LEU . 5.7 mm -121.73 34.64 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 121.081 0.467 . . . . 0.0 110.966 179.805 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 379' ' ' GLY . . . . . . . . . . . . . . . -149.31 69.75 0.33 Allowed Glycine 0 N--CA 1.453 -0.232 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.908 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.6 ' CG ' ' HD3' ' B' ' 445' ' ' ARG . 2.2 p90 -61.98 -59.87 4.46 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 -179.035 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 381' ' ' ALA . . . . . 0.576 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 170.29 -29.64 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.875 0.369 . . . . 0.0 111.59 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 382' ' ' SER . . . . . 0.488 ' HG ' ' HE2' ' B' ' 380' ' ' TYR . 0.3 OUTLIER -110.39 40.9 1.86 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.321 179.6 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.581 HD21 ' HB ' ' B' ' 406' ' ' VAL . 6.7 tt -115.35 -40.51 3.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.827 -179.604 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 65.3 65.97 0.55 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.198 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.828 HD11 HD12 ' B' ' 374' ' ' LEU . 0.7 OUTLIER -48.65 155.84 0.52 Allowed 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.482 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 386' ' ' HIS . . . . . 0.505 ' HB3' ' HG2' ' B' ' 405' ' ' ARG . 0.9 OUTLIER -153.3 98.17 2.24 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -178.681 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.75 ' HB2' ' HA ' ' B' ' 404' ' ' CYS . 0.1 OUTLIER -139.72 151.54 45.94 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.929 176.553 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -144.51 163.65 13.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.749 -177.079 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 3.4 m -102.78 129.95 49.59 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.077 0.465 . . . . 0.0 110.898 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 0.629 HG23 HG23 ' B' ' 401' ' ' ILE . 5.4 m -134.92 162.42 38.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.01 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.56 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 98.92 28.55 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.206 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.526 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.1 OUTLIER 0.37 117.52 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.679 0 O-C-N 124.119 0.887 . . . . 0.0 112.247 179.851 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.496 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 18.7 Cg_exo -62.72 158.35 42.68 Favored 'Trans proline' 0 N--CA 1.463 -0.304 0 C-N-CA 122.477 2.118 . . . . 0.0 113.401 -179.229 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 394' ' ' THR . . . . . 0.491 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 15.9 p -137.96 167.53 21.57 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.5 -1.227 . . . . 0.0 111.096 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -92.29 17.19 10.12 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-O 121.262 0.553 . . . . 0.0 110.22 179.165 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 396' ' ' VAL . . . . . 0.407 ' O ' ' CG ' ' B' ' 397' ' ' ASP . 17.4 m -125.67 -6.52 5.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.166 -0.924 . . . . 0.0 109.944 177.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 397' ' ' ASP . . . . . 0.465 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 28.9 m-20 179.45 54.46 0.05 OUTLIER Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 114.623 -1.172 . . . . 0.0 108.749 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.496 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 57.6 Cg_exo -31.76 -38.38 0.07 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 123.746 2.964 . . . . 0.0 113.643 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.607 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -28.31 139.91 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.493 0.663 . . . . 0.0 112.652 -177.775 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 400' ' ' SER . . . . . 0.426 ' O ' ' HB2' ' B' ' 423' ' ' ALA . 12.0 t -141.09 148.79 40.7 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.964 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 0.629 HG23 HG23 ' B' ' 390' ' ' VAL . 12.1 tt -107.57 156.22 8.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 121.133 0.492 . . . . 0.0 111.875 -179.508 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.734 HG23 ' O ' ' B' ' 415' ' ' GLY . 0.2 OUTLIER -127.99 141.1 47.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.652 -179.381 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 0.573 ' O ' ' HB2' ' B' ' 387' ' ' TYR . 0.7 OUTLIER -100.76 94.1 5.9 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.027 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.75 ' HA ' ' HB2' ' B' ' 387' ' ' TYR . 1.1 p -82.26 99.08 9.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.861 0.839 . . . . 0.0 110.391 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.741 ' HB2' HG22 ' B' ' 411' ' ' VAL . 0.2 OUTLIER -132.48 164.63 26.15 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.704 -178.71 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.581 ' HB ' HD21 ' B' ' 383' ' ' LEU . 1.2 m -132.59 128.5 57.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.953 0.406 . . . . 0.0 111.96 -178.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 407' ' ' GLY . . . . . 0.478 ' O ' ' HB3' ' B' ' 408' ' ' ASP . . . 79.64 8.49 87.68 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.921 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 408' ' ' ASP . . . . . 0.481 ' C ' ' HD2' ' B' ' 405' ' ' ARG . 9.2 t70 66.88 11.68 8.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.87 0.367 . . . . 0.0 110.632 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -125.97 -37.29 0.51 Allowed Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.492 -0.861 . . . . 0.0 112.99 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.623 HG22 HD13 ' B' ' 412' ' ' LEU . 95.0 m -103.13 136.77 42.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.959 0.409 . . . . 0.0 112.035 -179.097 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 411' ' ' VAL . . . . . 0.741 HG22 ' HB2' ' B' ' 405' ' ' ARG . 79.1 t -120.15 80.25 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.726 179.382 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.751 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.1 OUTLIER -41.19 -38.66 1.14 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.889 179.75 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 413' ' ' GLY . . . . . 0.468 ' O ' ' SG ' ' B' ' 404' ' ' CYS . . . 172.34 -169.73 42.82 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.374 -0.917 . . . . 0.0 112.916 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.446 ' C ' ' OD1' ' B' ' 430' ' ' ASN . 2.2 t -145.21 138.09 26.25 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.754 0.312 . . . . 0.0 111.207 -178.81 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.734 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -117.87 133.43 10.45 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.239 -0.982 . . . . 0.0 113.761 -179.013 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 416' ' ' VAL . . . . . 0.492 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 11.7 p -117.38 153.96 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 178.555 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.938 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -161.98 157.64 29.46 Favored Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.18 -1.01 . . . . 0.0 111.67 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.541 ' HA ' ' CB ' ' B' ' 399' ' ' ASN . 1.9 ptm180 -73.67 -40.29 63.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.918 0.39 . . . . 0.0 111.608 -179.324 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.826 ' H ' HD11 ' B' ' 422' ' ' ILE . 8.2 t30 -100.91 27.17 6.2 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.65 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.697 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 54.91 -47.76 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 179.82 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.503 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -43.62 -59.02 2.37 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.116 -0.633 . . . . 0.0 109.377 -179.714 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.938 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -44.39 -22.2 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.325 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.844 177.906 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -80.95 -49.79 10.54 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 177.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 424' ' ' GLY . . . . . 0.506 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -56.36 -48.65 74.02 Favored Glycine 0 C--N 1.337 0.631 0 C-N-CA 119.586 -1.292 . . . . 0.0 110.3 178.344 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.606 ' N ' HD12 ' B' ' 425' ' ' ILE . 1.2 mp -65.4 -64.75 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 177.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.616 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 14.8 tpt180 -39.08 -31.27 0.07 Allowed 'General case' 0 C--O 1.225 -0.196 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.607 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -65.25 -52.32 55.23 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 178.053 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 0.78 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -55.91 -51.83 66.23 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 177.516 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.692 ' HA ' HD22 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -57.93 -31.65 67.02 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.862 179.251 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.593 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 19.0 m120 -57.43 -41.21 80.01 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.562 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.619 ' HB3' HD21 ' B' ' 374' ' ' LEU . . . -69.03 -45.14 71.23 Favored 'General case' 0 CA--C 1.527 0.084 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.686 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.964 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -77.67 -9.84 59.19 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.841 0.353 . . . . 0.0 111.445 -179.382 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 433' ' ' ARG . . . . . 0.739 ' N ' HD23 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -80.08 16.82 1.12 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.672 -179.504 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.48 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 90.3 m-20 -140.27 79.85 1.73 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.656 0.265 . . . . 0.0 110.337 179.103 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.589 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -46.69 -58.5 3.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.801 -179.551 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.589 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 1.6 mmpp? -49.65 -37.14 27.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.89 0.376 . . . . 0.0 110.451 -179.45 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.751 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.5 OUTLIER -73.84 -51.46 16.21 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.498 179.284 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.964 HD11 ' HA ' ' B' ' 432' ' ' LEU . 90.0 mt -52.36 -61.7 2.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.283 0.563 . . . . 0.0 110.691 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 439' ' ' ASP . . . . . 0.475 ' O ' ' N ' ' B' ' 442' ' ' ALA . 3.5 t70 -48.69 -51.13 30.15 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 178.869 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.479 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -40.13 -42.65 1.49 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.063 179.83 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.55 ' HA ' ' HG2' ' B' ' 444' ' ' GLN . 49.8 m-85 -67.72 -42.02 82.59 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.781 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 442' ' ' ALA . . . . . 0.475 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -43.04 -59.31 2.07 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 177.76 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.2 -42.91 41.69 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 177.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.55 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -73.39 3.59 5.78 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.906 179.017 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.6 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -99.23 -45.02 6.03 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.371 179.238 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -79.38 -34.8 41.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.728 179.605 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.792 -179.835 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 366' ' ' LEU . . . . . 0.466 HD23 ' HB3' ' B' ' 368' ' ' MET . 0.2 OUTLIER . . . . . 0 N--CA 1.455 -0.189 0 CA-C-O 120.877 0.37 . . . . 0.0 111.081 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.457 ' OD2' HG13 ' B' ' 425' ' ' ILE . 3.9 t70 -59.58 -61.56 2.53 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.809 179.329 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.524 ' O ' ' HB2' ' B' ' 372' ' ' ARG . 8.8 ttp -34.6 -50.47 0.45 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.611 179.477 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -61.92 -48.01 82.35 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.694 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 0.935 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -64.94 -72.5 0.15 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.743 0.306 . . . . 0.0 110.69 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.516 ' CD ' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -34.86 -42.55 0.16 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.857 179.828 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.556 ' O ' ' CB ' ' B' ' 376' ' ' SER . 1.8 ttp-105 -66.64 -39.23 88.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.235 -179.792 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.781 HE22 ' HG ' ' B' ' 377' ' ' LEU . 1.4 tm0? -62.49 -54.67 36.63 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.209 0.528 . . . . 0.0 110.415 179.54 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 0.545 HD21 ' O ' ' B' ' 428' ' ' ALA . 1.1 mm? -55.93 -68.53 0.2 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.267 -0.878 . . . . 0.0 113.048 -179.102 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 375' ' ' TYR . . . . . 0.469 ' O ' ' O ' ' B' ' 378' ' ' ILE . 3.5 m-85 -74.91 -45.13 44.72 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -177.557 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.556 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -70.8 -54.25 12.33 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.319 -0.552 . . . . 0.0 111.386 -179.404 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.781 ' HG ' HE22 ' B' ' 373' ' ' GLN . 0.0 OUTLIER -71.02 -43.59 67.61 Favored 'General case' 0 CA--C 1.509 -0.618 0 CA-C-O 121.196 0.522 . . . . 0.0 109.971 -178.856 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.627 HG23 ' HB3' ' B' ' 441' ' ' TYR . 2.4 mm -120.36 -138.5 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.926 0 CA-C-N 115.374 -0.83 . . . . 0.0 108.878 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.522 ' O ' ' O ' ' B' ' 380' ' ' TYR . . . 99.53 -22.37 40.91 Favored Glycine 0 C--N 1.321 -0.3 0 C-N-CA 120.943 -0.646 . . . . 0.0 112.089 -179.678 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 1.094 ' CB ' HD22 ' B' ' 383' ' ' LEU . 0.1 OUTLIER 34.92 -175.41 0.0 OUTLIER 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 178.867 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -121.16 -28.2 4.76 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 113.092 -1.867 . . . . 0.0 109.985 179.34 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -143.57 50.49 1.37 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.653 179.622 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 1.094 HD22 ' CB ' ' B' ' 380' ' ' TYR . 0.8 OUTLIER -116.4 -36.14 4.09 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 120.913 0.387 . . . . 0.0 110.421 178.857 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 384' ' ' ARG . . . . . 0.72 ' H ' HD23 ' B' ' 383' ' ' LEU . 1.9 tpt85 74.71 78.76 0.11 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.718 179.173 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.678 ' HG ' HG12 ' B' ' 406' ' ' VAL . 9.7 tt -107.25 124.29 49.54 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 178.837 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 386' ' ' HIS . . . . . 0.421 ' O ' ' O ' ' B' ' 405' ' ' ARG . 26.4 p-80 -145.22 145.91 31.5 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 -178.185 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.676 ' HE1' HD21 ' B' ' 385' ' ' LEU . 3.9 m-85 -106.05 147.74 28.55 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 114.56 -1.2 . . . . 0.0 111.066 178.319 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 388' ' ' VAL . . . . . 0.535 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -133.43 128.64 55.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.351 179.448 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.2 m -86.83 123.75 32.31 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.963 179.261 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 0.907 HG23 HG23 ' B' ' 401' ' ' ILE . 29.1 m -130.06 154.84 40.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.363 0.602 . . . . 0.0 112.222 -179.314 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.54 ' O ' ' C ' ' B' ' 392' ' ' LYS . 4.4 tptt 90.7 23.68 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.544 179.508 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.54 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.1 OUTLIER 1.71 108.37 0.01 OUTLIER Pre-proline 0 N--CA 1.468 0.439 0 O-C-N 123.966 0.792 . . . . 0.0 112.44 179.766 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.492 ' HD2' ' HA ' ' B' ' 392' ' ' LYS . 6.0 Cg_exo -45.55 160.41 0.16 Allowed 'Trans proline' 0 N--CA 1.462 -0.33 0 C-N-CA 122.856 2.37 . . . . 0.0 113.514 -179.174 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 31.8 p -127.2 169.76 13.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.53 179.286 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -96.19 20.21 10.65 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 121.24 0.543 . . . . 0.0 110.715 179.626 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 33.6 m -136.05 6.64 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.005 178.15 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 397' ' ' ASP . . . . . 0.455 ' O ' ' N ' ' B' ' 399' ' ' ASN . 0.2 OUTLIER 168.17 58.09 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 114.949 -1.023 . . . . 0.0 108.847 -179.38 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.477 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 3.3 Cg_exo -35.64 -27.3 0.05 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 124.062 3.175 . . . . 0.0 113.108 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.599 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 1.3 p-10 -29.28 120.43 0.14 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.619 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 400' ' ' SER . . . . . 0.428 ' OG ' ' HD3' ' B' ' 393' ' ' PRO . 48.9 m -130.71 158.17 40.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.906 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 0.907 HG23 HG23 ' B' ' 390' ' ' VAL . 0.4 OUTLIER -115.14 144.89 21.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.991 -179.796 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.677 HG21 ' C ' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -110.77 157.59 11.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.558 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 0.535 ' CB ' HG23 ' B' ' 388' ' ' VAL . 2.4 mm-40 -123.9 119.4 29.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.102 179.0 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.59 ' HB3' ' CZ ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -102.39 103.23 13.63 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.669 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.54 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.8 OUTLIER -142.68 170.44 15.7 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.125 -179.305 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.678 HG12 ' HG ' ' B' ' 385' ' ' LEU . 1.0 OUTLIER -148.57 177.69 0.88 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.547 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.515 -179.03 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 58.2 -102.84 0.28 Allowed Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 115.153 -0.93 . . . . 0.0 112.577 179.707 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -158.13 21.16 0.25 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.751 0.31 . . . . 0.0 110.842 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 170.99 31.95 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.667 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.54 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 99.3 m -124.31 111.68 16.1 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 121.05 -0.26 . . . . 0.0 110.983 179.519 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 58.2 t -103.61 107.43 22.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 178.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.564 ' HB3' ' HA ' ' B' ' 431' ' ' ALA . 0.0 OUTLIER -68.42 -26.11 65.37 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.633 -179.829 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 413' ' ' GLY . . . . . 0.464 ' O ' ' SG ' ' B' ' 404' ' ' CYS . . . 174.34 -177.22 46.61 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.874 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.443 ' O ' ' ND2' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -146.37 152.68 39.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.787 -0.206 . . . . 0.0 110.79 -179.832 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.437 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -149.53 158.06 27.5 Favored Glycine 0 C--O 1.227 -0.302 0 C-N-CA 119.757 -1.211 . . . . 0.0 113.647 -179.424 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 416' ' ' VAL . . . . . 0.418 ' HB ' HD12 ' B' ' 401' ' ' ILE . 1.4 p -141.4 151.41 19.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.528 -0.336 . . . . 0.0 110.779 179.761 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.817 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . -165.18 142.91 8.05 Favored Glycine 0 C--O 1.228 -0.265 0 C-N-CA 120.957 -0.639 . . . . 0.0 111.732 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.52 ' CG ' ' OD1' ' B' ' 419' ' ' ASN . 4.7 ptm180 -60.64 -43.77 97.18 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -179.059 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.726 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.1 OUTLIER -100.19 34.35 2.37 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 178.893 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.755 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 51.09 -46.39 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 N-CA-C 114.746 1.387 . . . . 0.0 114.746 179.328 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.577 ' N ' HD12 ' B' ' 420' ' ' ILE . 0.0 OUTLIER -43.96 -58.61 2.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 118.784 0.72 . . . . 0.0 109.768 -179.71 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.817 HD13 ' CA ' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -45.06 -19.84 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 177.261 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.755 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -88.0 -49.26 7.17 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 177.607 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 424' ' ' GLY . . . . . 0.464 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -58.8 -44.79 95.68 Favored Glycine 0 C--N 1.339 0.708 0 C-N-CA 119.914 -1.136 . . . . 0.0 110.775 178.538 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.457 HG13 ' OD2' ' B' ' 367' ' ' ASP . 2.4 mp -67.25 -64.86 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 178.055 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.601 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -40.41 -26.56 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.816 179.039 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.625 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -73.91 -55.28 6.36 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.529 179.428 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 0.935 ' CB ' ' HB1' ' B' ' 370' ' ' ALA . . . -50.7 -50.57 54.82 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.028 0.442 . . . . 0.0 110.203 179.386 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.792 ' HA ' HD22 ' B' ' 432' ' ' LEU . 0.6 OUTLIER -58.7 -66.15 0.54 Allowed 'General case' 0 C--O 1.218 -0.553 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 178.094 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.502 ' C ' ' O ' ' B' ' 429' ' ' GLU . 0.3 OUTLIER -24.83 -42.29 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.267 179.512 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.564 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -78.23 -39.12 41.31 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.286 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.832 ' C ' HD23 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -78.75 8.42 5.44 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.146 0.498 . . . . 0.0 111.576 179.812 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 433' ' ' ARG . . . . . 0.552 ' N ' HD23 ' B' ' 432' ' ' LEU . 0.1 OUTLIER -87.64 -5.25 58.8 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.516 -179.426 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.47 ' OD2' ' HB2' ' B' ' 437' ' ' MET . 54.1 t0 -107.02 90.77 3.4 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.843 0.354 . . . . 0.0 111.283 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.551 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.2 OUTLIER -51.62 -53.3 39.93 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.019 179.94 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.551 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.2 OUTLIER -54.52 -43.66 72.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.973 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.545 ' CE ' ' HG ' ' B' ' 412' ' ' LEU . 16.6 tmm? -69.86 -55.4 9.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.852 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.82 HD21 ' HA ' ' B' ' 432' ' ' LEU . 69.7 mt -52.81 -62.79 1.42 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.276 0.56 . . . . 0.0 110.337 179.471 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 439' ' ' ASP . . . . . 0.431 ' O ' ' N ' ' B' ' 442' ' ' ALA . 14.1 t0 -50.53 -47.27 57.61 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.244 -0.889 . . . . 0.0 108.924 178.665 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.588 ' CZ ' ' NE2' ' B' ' 444' ' ' GLN . 0.5 OUTLIER -44.12 -41.16 5.44 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.264 179.565 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.627 ' HB3' HG23 ' B' ' 378' ' ' ILE . 43.2 m-85 -74.2 -31.83 62.81 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.436 179.502 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 442' ' ' ALA . . . . . 0.431 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -59.32 -61.94 2.25 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.903 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.01 -42.58 63.14 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 178.4 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.588 ' NE2' ' CZ ' ' B' ' 440' ' ' PHE . 3.1 mm-40 -54.48 -56.19 21.27 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.547 -0.752 . . . . 0.0 109.691 178.685 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.477 ' HD3' ' CD1' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -46.43 -38.21 8.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.96 179.649 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -77.29 -40.19 45.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.765 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.842 -179.69 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 366' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.456 -0.129 0 CA-C-O 120.735 0.302 . . . . 0.0 111.1 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.535 ' O ' ' N ' ' B' ' 370' ' ' ALA . 4.8 t0 -57.58 -65.61 0.6 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.906 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.546 ' HA ' ' CE ' ' B' ' 371' ' ' LYS . 4.5 tmm? -36.86 -46.84 0.65 Allowed 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.338 0.589 . . . . 0.0 110.256 179.512 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -61.94 -40.71 96.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.684 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 1.006 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -63.79 -70.36 0.22 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.854 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.548 ' HG2' ' N ' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -35.67 -45.72 0.39 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.842 0.353 . . . . 0.0 110.294 -179.809 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.55 ' O ' ' CB ' ' B' ' 376' ' ' SER . 5.4 tmm_? -62.32 -39.78 94.17 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.861 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.766 HE22 HD22 ' B' ' 438' ' ' LEU . 4.3 tm0? -62.05 -58.4 7.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.281 0.562 . . . . 0.0 110.75 179.187 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 0.768 HD23 ' N ' ' B' ' 374' ' ' LEU . 0.9 OUTLIER -50.85 -70.39 0.09 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.992 -1.003 . . . . 0.0 113.136 -178.607 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 375' ' ' TYR . . . . . 0.551 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.0 m-85 -72.65 -49.92 28.58 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -177.305 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.55 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -65.61 -54.83 22.31 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -178.445 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.909 ' O ' HD13 ' B' ' 378' ' ' ILE . 3.3 tp -75.53 -26.43 58.05 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.909 HD13 ' O ' ' B' ' 377' ' ' LEU . 10.9 mm -125.18 -58.03 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.585 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.551 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -36.61 105.58 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.734 -0.746 . . . . 0.0 113.095 -179.302 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.758 ' CD2' HD12 ' B' ' 383' ' ' LEU . 18.1 p90 -119.58 171.48 8.34 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.758 0.313 . . . . 0.0 110.632 179.33 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 381' ' ' ALA . . . . . 0.526 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -62.9 104.42 0.55 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.087 -179.742 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 382' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 2.2 t 86.11 45.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.388 179.701 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.895 HD23 ' O ' ' B' ' 383' ' ' LEU . 6.3 tt -97.72 -33.62 11.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.596 179.584 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 384' ' ' ARG . . . . . 0.528 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 0.0 OUTLIER 65.53 62.14 0.67 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.914 179.857 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.839 ' HB2' HD22 ' B' ' 383' ' ' LEU . 1.6 tt -108.45 127.97 54.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.661 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 386' ' ' HIS . . . . . 0.697 ' N ' HD23 ' B' ' 385' ' ' LEU . 35.7 p-80 -154.8 156.79 36.89 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -179.275 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.621 ' OH ' HD13 ' B' ' 374' ' ' LEU . 3.6 m-85 -112.45 152.43 28.72 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 114.374 -1.285 . . . . 0.0 110.892 178.37 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 388' ' ' VAL . . . . . 0.988 HG23 ' HB3' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -135.51 135.14 51.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.712 179.613 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.4 m -95.22 127.13 41.03 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.457 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 0.982 HG23 HG23 ' B' ' 401' ' ' ILE . 31.6 m -131.8 157.85 43.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.198 -179.685 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.696 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 87.38 21.73 0.06 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.52 179.737 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.535 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER 0.98 116.83 0.0 OUTLIER Pre-proline 0 N--CA 1.472 0.663 0 O-C-N 124.001 0.813 . . . . 0.0 112.476 179.884 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.483 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 20.5 Cg_exo -61.78 162.73 20.84 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 122.472 2.115 . . . . 0.0 112.641 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 394' ' ' THR . . . . . 0.504 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 0.7 OUTLIER -155.49 166.11 34.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.159 -179.815 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -82.52 8.92 10.39 Favored 'General case' 0 CA--C 1.527 0.089 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.45 178.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 396' ' ' VAL . . . . . 0.435 HG22 ' OG1' ' B' ' 394' ' ' THR . 19.1 m -129.61 11.0 2.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.655 0.74 . . . . 0.0 109.208 178.069 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 397' ' ' ASP . . . . . 0.414 ' H ' ' HD3' ' B' ' 398' ' ' PRO . 0.4 OUTLIER 168.68 60.07 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 114.605 -1.18 . . . . 0.0 109.297 -179.908 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.504 ' HA ' ' H ' ' B' ' 394' ' ' THR . 90.3 Cg_exo -43.99 -54.58 3.71 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.047 2.498 . . . . 0.0 112.759 -179.594 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.552 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 18.9 p30 -25.27 132.06 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.989 -178.483 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 400' ' ' SER . . . . . 0.471 ' HB2' ' HG3' ' B' ' 393' ' ' PRO . 4.5 t -137.94 152.84 49.36 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.795 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 0.982 HG23 HG23 ' B' ' 390' ' ' VAL . 0.3 OUTLIER -114.92 141.21 32.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.067 0.46 . . . . 0.0 111.201 -179.631 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.673 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -106.27 158.24 6.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.431 179.672 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 0.988 ' HB3' HG23 ' B' ' 388' ' ' VAL . 63.4 tt0 -125.47 114.41 18.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.884 179.249 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.614 ' HB3' ' CZ ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -99.8 103.31 14.93 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.278 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.59 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.1 OUTLIER -144.41 169.36 18.07 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.327 -179.25 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.662 HG11 ' HG ' ' B' ' 385' ' ' LEU . 0.9 OUTLIER -149.76 -177.25 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.336 -178.942 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 407' ' ' GLY . . . . . 0.514 ' N ' HG23 ' B' ' 406' ' ' VAL . . . 56.57 -104.52 0.38 Allowed Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.658 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -155.25 18.44 0.42 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.874 0.369 . . . . 0.0 110.936 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 169.32 33.55 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 121.001 -0.619 . . . . 0.0 112.284 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.59 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 1.2 m -120.07 111.72 18.24 Favored 'General case' 0 C--O 1.22 -0.498 0 O-C-N 123.0 -0.118 . . . . 0.0 110.756 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 57.8 t -105.14 104.18 16.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.65 0.262 . . . . 0.0 110.53 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.715 HD13 ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -62.33 -26.89 68.68 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 179.345 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 413' ' ' GLY . . . . . 0.479 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 172.44 -171.57 44.37 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.121 -1.037 . . . . 0.0 113.181 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.461 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -145.79 147.68 32.13 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.664 -0.268 . . . . 0.0 110.704 -179.671 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.529 ' HA2' ' HG2' ' B' ' 426' ' ' ARG . . . -140.72 150.36 21.64 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 119.9 -1.143 . . . . 0.0 112.936 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 416' ' ' VAL . . . . . 0.779 ' HB ' HD12 ' B' ' 401' ' ' ILE . 1.6 p -152.02 137.3 10.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.788 0.327 . . . . 0.0 111.355 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.942 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -149.74 177.36 27.93 Favored Glycine 0 C--O 1.226 -0.344 0 C-N-CA 120.856 -0.688 . . . . 0.0 111.962 179.676 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.496 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 4.4 ptt85 -85.5 -45.52 11.72 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -179.617 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.684 ' H ' HD11 ' B' ' 422' ' ' ILE . 14.8 t30 -98.85 39.68 1.25 Allowed 'General case' 0 C--O 1.223 -0.332 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.686 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 1.0 OUTLIER 46.34 -47.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 179.069 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.663 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -42.35 -58.22 2.28 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 118.378 0.536 . . . . 0.0 109.893 -179.081 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.942 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -46.69 -17.57 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.567 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.916 178.246 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.686 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -86.49 -49.84 7.29 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.863 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 424' ' ' GLY . . . . . 0.501 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -57.33 -46.48 91.75 Favored Glycine 0 C--N 1.34 0.774 0 C-N-CA 119.824 -1.179 . . . . 0.0 110.781 178.722 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.593 ' N ' HD12 ' B' ' 425' ' ' ILE . 1.3 mp -66.55 -65.0 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.068 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.615 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -39.7 -31.62 0.11 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.045 178.691 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.58 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -63.7 -59.88 4.02 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.462 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 1.006 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -58.95 -54.32 48.43 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 178.296 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.658 ' OE2' ' HB2' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -53.12 -18.09 1.97 Allowed 'General case' 0 C--N 1.334 -0.076 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.339 178.602 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.525 ' ND2' ' O ' ' B' ' 426' ' ' ARG . 0.7 OUTLIER -82.07 -36.39 27.7 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.311 178.985 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.507 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -71.15 -37.17 72.25 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -178.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.865 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -83.85 12.2 6.44 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.044 179.968 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -99.17 -8.98 24.34 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.389 -179.352 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.493 ' O ' ' HG ' ' B' ' 438' ' ' LEU . 29.8 t0 -108.68 87.36 2.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.068 0.461 . . . . 0.0 111.203 -179.602 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.568 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -53.0 -53.15 54.4 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.088 -179.963 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.568 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 7.5 mttm -52.15 -46.72 65.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.99 -179.597 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.479 ' O ' ' HB3' ' B' ' 440' ' ' PHE . 14.3 tmm? -68.4 -50.85 49.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.979 0.419 . . . . 0.0 110.338 179.476 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.865 HD11 ' HA ' ' B' ' 432' ' ' LEU . 58.3 mt -51.73 -62.37 1.67 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.546 179.419 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 439' ' ' ASP . . . . . 0.451 ' O ' ' HB3' ' B' ' 442' ' ' ALA . 48.9 t0 -57.37 -39.18 75.48 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.232 178.843 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.48 ' CD1' ' C ' ' B' ' 440' ' ' PHE . 0.0 OUTLIER -45.94 -49.76 15.43 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.189 179.497 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.475 ' HA ' ' HB2' ' B' ' 444' ' ' GLN . 60.8 m-85 -65.15 -37.42 87.34 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.504 179.313 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 442' ' ' ALA . . . . . 0.455 ' O ' ' N ' ' B' ' 445' ' ' ARG . . . -45.52 -62.07 1.43 Allowed 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 178.23 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -48.36 -47.66 37.07 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 178.139 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.475 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 8.0 mm-40 -65.67 -5.7 9.23 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.046 178.802 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.536 ' HD3' ' CB ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -89.51 -42.25 11.57 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.1 179.79 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -71.46 -31.14 66.82 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.986 179.286 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.409 179.825 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 366' ' ' LEU . . . . . 0.792 HD12 ' H ' ' B' ' 367' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.455 -0.215 0 CA-C-O 120.71 0.29 . . . . 0.0 110.34 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.792 ' H ' HD12 ' B' ' 366' ' ' LEU . 30.0 t70 -41.93 -77.45 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.426 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.559 ' HA ' ' CD ' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -36.11 -41.72 0.27 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.52 179.414 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 369' ' ' ASN . . . . . 0.512 ' N ' ' HG3' ' B' ' 368' ' ' MET . 0.9 OUTLIER -63.96 -45.82 87.41 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.034 -179.785 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 1.002 ' HB3' ' HB1' ' B' ' 428' ' ' ALA . . . -61.92 -68.53 0.31 Allowed 'General case' 0 C--O 1.223 -0.322 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 179.441 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.559 ' CD ' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -35.64 -44.89 0.34 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.795 0.331 . . . . 0.0 110.547 179.946 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.556 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.0 OUTLIER -64.64 -36.03 82.92 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-O 121.329 0.585 . . . . 0.0 110.247 179.209 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.963 ' O ' HG23 ' B' ' 378' ' ' ILE . 1.5 tm0? -62.51 -46.1 89.95 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.98 179.46 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 1.038 HD12 HD21 ' B' ' 385' ' ' LEU . 0.1 OUTLIER -71.71 -65.73 0.72 Allowed 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -178.126 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 375' ' ' TYR . . . . . 0.633 ' CE1' HD11 ' B' ' 385' ' ' LEU . 2.5 m-85 -78.96 -7.25 57.87 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.337 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.556 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.2 OUTLIER -128.2 4.13 5.79 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.851 0.686 . . . . 0.0 112.851 -179.12 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.846 HD23 ' CD ' ' B' ' 373' ' ' GLN . 49.4 tp -152.52 -2.74 0.25 Allowed 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -179.825 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.963 HG23 ' O ' ' B' ' 373' ' ' GLN . 0.7 OUTLIER -131.52 -51.93 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.101 0 C-N-CA 119.442 -0.903 . . . . 0.0 112.324 179.602 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.795 ' CA ' HD21 ' B' ' 383' ' ' LEU . . . -114.36 -151.45 10.36 Favored Glycine 0 N--CA 1.445 -0.765 0 C-N-CA 119.529 -1.32 . . . . 0.0 113.607 -179.117 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.481 ' CD1' ' C ' ' B' ' 379' ' ' GLY . 0.1 OUTLIER -155.09 -84.47 0.06 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.175 -0.513 . . . . 0.0 110.124 -179.389 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -170.59 25.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.692 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 382' ' ' SER . . . . . 0.493 ' O ' ' HG2' ' B' ' 384' ' ' ARG . 0.1 OUTLIER -131.73 -43.71 0.99 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.668 0.27 . . . . 0.0 111.034 179.874 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.822 HD12 ' N ' ' B' ' 384' ' ' ARG . 1.1 pp -61.32 -15.01 31.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.949 0.404 . . . . 0.0 110.772 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 384' ' ' ARG . . . . . 0.822 ' N ' HD12 ' B' ' 383' ' ' LEU . 15.0 mmt180 70.1 66.93 0.22 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.693 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 1.038 HD21 HD12 ' B' ' 374' ' ' LEU . 0.0 OUTLIER -102.12 132.8 47.8 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.88 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 386' ' ' HIS . . . . . 0.986 ' N ' HD22 ' B' ' 385' ' ' LEU . 30.8 p-80 -176.31 -177.39 0.86 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.627 0.727 . . . . 0.0 112.684 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.564 ' CE2' ' HB3' ' B' ' 404' ' ' CYS . 2.6 m-85 -118.96 165.18 14.41 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-N 114.749 -1.114 . . . . 0.0 110.156 178.617 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 388' ' ' VAL . . . . . 0.531 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -149.62 112.3 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 CA-C-O 121.484 0.659 . . . . 0.0 112.047 179.388 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 13.2 m -72.76 130.01 39.51 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.974 179.78 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 0.828 HG23 HG23 ' B' ' 401' ' ' ILE . 29.6 m -136.96 153.22 29.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.985 -179.672 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.53 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 86.16 28.47 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.351 -179.406 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.507 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.8 OUTLIER -8.58 119.06 0.03 OUTLIER Pre-proline 0 N--CA 1.467 0.41 0 O-C-N 124.148 0.905 . . . . 0.0 112.587 -179.717 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.487 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 2.0 Cg_endo -49.09 167.68 0.13 Allowed 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.703 2.269 . . . . 0.0 112.591 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 394' ' ' THR . . . . . 0.431 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 52.2 p -150.33 158.86 44.62 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.39 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -77.65 5.7 8.72 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 120.962 0.41 . . . . 0.0 111.139 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 15.2 m -133.22 12.98 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.535 0.683 . . . . 0.0 109.387 178.33 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 174.22 56.93 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.004 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.51 ' O ' ' C ' ' B' ' 399' ' ' ASN . 60.0 Cg_exo -35.72 -57.1 0.54 Allowed 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 123.081 2.52 . . . . 0.0 112.71 -179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.553 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 2.0 m-20 -13.52 125.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.924 -179.404 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 38.7 t -132.33 142.37 49.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.781 179.199 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 0.828 HG23 HG23 ' B' ' 390' ' ' VAL . 0.1 OUTLIER -109.6 134.13 52.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-O 121.104 0.478 . . . . 0.0 111.328 -179.366 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.908 HG21 ' O ' ' B' ' 423' ' ' ALA . 2.0 t -98.16 154.73 3.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.76 179.542 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 0.531 ' CB ' HG23 ' B' ' 388' ' ' VAL . 8.4 mm-40 -130.7 104.29 7.1 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.367 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.564 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -92.5 107.22 19.05 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.659 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.521 ' HA ' ' O ' ' B' ' 410' ' ' THR . 10.5 ptm180 -147.21 164.95 31.52 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.894 -179.423 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.6 HG12 ' HA ' ' B' ' 385' ' ' LEU . 1.6 m -144.2 144.44 22.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.01 -179.544 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 68.56 3.86 35.66 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.42 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 67.11 12.31 8.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.704 0.288 . . . . 0.0 110.799 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -133.68 -5.19 2.91 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.474 -0.869 . . . . 0.0 113.239 -179.633 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.521 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 63.8 m -130.06 122.98 29.4 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-N 116.992 0.396 . . . . 0.0 111.935 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 9.6 t -107.26 96.07 4.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.834 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.554 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -54.53 -21.86 11.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.011 0.434 . . . . 0.0 110.301 179.648 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 160.12 -161.51 32.52 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.69 -0.766 . . . . 0.0 112.299 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 414' ' ' THR . . . . . 0.504 ' OG1' HD11 ' B' ' 401' ' ' ILE . 8.8 t -160.25 167.68 27.03 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.121 0.486 . . . . 0.0 111.471 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.51 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -141.3 154.61 24.69 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.654 -0.784 . . . . 0.0 113.582 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 416' ' ' VAL . . . . . 0.773 ' CG2' HD12 ' B' ' 401' ' ' ILE . 85.9 t -148.15 100.86 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 120.761 0.315 . . . . 0.0 110.777 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.957 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -113.95 162.53 12.36 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.626 -0.797 . . . . 0.0 111.768 179.756 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.425 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.0 OUTLIER -83.38 -50.68 8.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 117.125 0.462 . . . . 0.0 111.027 179.994 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.952 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.5 OUTLIER -80.01 -23.93 41.17 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 120.972 -0.291 . . . . 0.0 110.767 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.952 HG23 ' O ' ' B' ' 419' ' ' ASN . 1.2 pp 110.54 -39.77 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 124.523 1.129 . . . . 0.0 110.842 -179.631 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.558 ' N ' HD12 ' B' ' 420' ' ' ILE . 0.3 OUTLIER -45.86 -63.08 1.06 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.994 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.957 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -45.34 -24.45 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.282 177.316 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.908 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -72.75 -51.76 17.81 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.092 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 424' ' ' GLY . . . . . 0.501 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -64.0 -54.6 29.41 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.25 -0.976 . . . . 0.0 111.322 179.341 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.655 ' N ' HD13 ' B' ' 425' ' ' ILE . 2.1 mm -62.6 -71.08 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.575 0 CA-C-N 115.662 -0.269 . . . . 0.0 111.113 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.539 ' CG ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -46.34 -25.4 0.63 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.944 0.402 . . . . 0.0 110.83 -178.549 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.702 ' HB2' ' O ' ' B' ' 423' ' ' ALA . . . -62.56 -54.58 37.64 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 176.576 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 1.002 ' HB1' ' HB3' ' B' ' 370' ' ' ALA . . . -53.59 -50.84 64.76 Favored 'General case' 0 C--O 1.243 0.753 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 177.62 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.508 ' HA ' ' CD1' ' B' ' 432' ' ' LEU . 29.2 mt-10 -61.38 -8.54 4.08 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 115.085 -0.962 . . . . 0.0 111.402 179.168 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.537 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 24.8 m120 -86.48 -39.6 16.12 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.537 178.431 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.561 ' CB ' ' OH ' ' B' ' 387' ' ' TYR . . . -70.87 -34.39 71.56 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 -179.363 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.722 ' CD1' ' HB2' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -85.82 14.51 5.86 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.383 -0.527 . . . . 0.0 111.356 -179.897 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 8.2 ttt180 -94.89 -3.71 48.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.178 -179.46 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.548 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 18.2 m-20 -113.59 73.1 0.8 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.328 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.555 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 6.5 ptmt -41.89 -52.65 4.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.856 0.36 . . . . 0.0 110.579 179.713 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.555 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 1.4 mtpp -55.87 -45.17 78.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.212 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.554 ' SD ' HD12 ' B' ' 412' ' ' LEU . 15.5 tmm? -65.82 -52.3 51.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.082 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.791 HD22 ' OE1' ' B' ' 373' ' ' GLN . 24.3 mt -53.62 -65.37 0.58 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.617 179.297 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -46.51 -49.09 18.99 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.731 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.534 ' CE2' ' CZ ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -48.37 -42.23 31.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.532 0.682 . . . . 0.0 109.377 179.999 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.589 ' CB ' ' HB ' ' B' ' 378' ' ' ILE . 45.4 m-85 -73.02 -37.88 66.76 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.2 179.707 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -51.7 -59.47 4.25 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.409 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 3.4 ttmt -49.08 -45.24 42.82 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.504 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.8 OUTLIER -54.11 -49.04 70.04 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.058 178.543 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 445' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.72 -27.71 63.21 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.048 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -74.83 -41.61 59.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.976 0.417 . . . . 0.0 110.509 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.124 -179.933 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 366' ' ' LEU . . . . . 0.513 ' O ' ' HB2' ' B' ' 369' ' ' ASN . 6.7 tp . . . . . 0 N--CA 1.452 -0.326 0 CA-C-O 121.157 0.503 . . . . 0.0 110.982 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 367' ' ' ASP . . . . . 0.479 ' HB3' HG13 ' B' ' 425' ' ' ILE . 1.0 OUTLIER -46.84 -72.86 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 179.133 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 368' ' ' MET . . . . . 0.545 ' HE3' ' N ' ' B' ' 369' ' ' ASN . 3.5 tmm? -34.41 -42.48 0.14 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.773 179.591 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 369' ' ' ASN . . . . . 0.545 ' N ' ' HE3' ' B' ' 368' ' ' MET . 90.7 m-20 -59.99 -50.5 73.49 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.8 0.333 . . . . 0.0 110.704 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 370' ' ' ALA . . . . . 0.71 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -56.38 -68.31 0.22 Allowed 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 178.963 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 371' ' ' LYS . . . . . 0.425 ' C ' ' O ' ' B' ' 370' ' ' ALA . 2.5 mttm -33.85 -51.3 0.4 Allowed 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.9 179.809 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 372' ' ' ARG . . . . . 0.591 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.2 OUTLIER -56.64 -38.33 71.98 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.712 -179.843 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 373' ' ' GLN . . . . . 0.56 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.4 OUTLIER -62.87 -57.14 11.85 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.696 0.76 . . . . 0.0 110.159 178.955 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 374' ' ' LEU . . . . . 1.091 HD11 ' CB ' ' B' ' 428' ' ' ALA . 1.8 mt -48.8 -74.75 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 1.5 m-30 -98.14 4.39 49.05 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 -176.542 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 376' ' ' SER . . . . . 0.591 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.1 OUTLIER -116.2 -2.04 12.26 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.077 0.465 . . . . 0.0 110.211 178.705 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 377' ' ' LEU . . . . . 0.544 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.4 OUTLIER -133.42 -39.04 0.92 Allowed 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.082 177.901 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 378' ' ' ILE . . . . . 0.436 ' C ' ' O ' ' B' ' 374' ' ' LEU . 0.7 OUTLIER -127.15 -142.79 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.672 179.501 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 379' ' ' GLY . . . . . 0.51 ' O ' ' O ' ' B' ' 380' ' ' TYR . . . 93.26 -22.62 33.85 Favored Glycine 0 C--N 1.332 0.342 0 C-N-CA 120.535 -0.84 . . . . 0.0 113.139 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 380' ' ' TYR . . . . . 0.633 ' CD2' ' HB3' ' B' ' 383' ' ' LEU . 0.2 OUTLIER 36.93 -175.23 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 115.258 1.577 . . . . 0.0 115.258 179.57 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -123.42 -21.46 5.31 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 113.734 -1.575 . . . . 0.0 111.183 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 37.9 t -160.14 44.84 0.22 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.136 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 383' ' ' LEU . . . . . 0.818 ' C ' HD13 ' B' ' 383' ' ' LEU . 0.0 OUTLIER -114.05 -3.99 13.24 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.861 0.362 . . . . 0.0 111.018 178.749 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 384' ' ' ARG . . . . . 0.777 ' N ' HD13 ' B' ' 383' ' ' LEU . 11.9 tpt180 75.86 71.63 0.08 Allowed 'General case' 0 C--O 1.227 -0.127 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 178.327 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 385' ' ' LEU . . . . . 0.661 ' HB2' HD11 ' B' ' 383' ' ' LEU . 7.3 tt -135.32 123.88 23.57 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.451 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 386' ' ' HIS . . . . . 0.492 ' N ' HD23 ' B' ' 385' ' ' LEU . 7.5 p-80 -158.91 146.17 17.47 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 -178.734 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 387' ' ' TYR . . . . . 0.745 ' CZ ' HD13 ' B' ' 374' ' ' LEU . 39.2 m-85 -96.56 132.77 41.82 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 114.095 -1.411 . . . . 0.0 110.823 178.172 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -122.17 130.82 74.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.52 179.575 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.1 m -91.96 121.17 33.3 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.291 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 390' ' ' VAL . . . . . 1.01 HG23 HG23 ' B' ' 401' ' ' ILE . 27.5 m -128.9 152.35 36.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.309 -179.265 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 391' ' ' LYS . . . . . 0.65 ' HB2' HG22 ' B' ' 401' ' ' ILE . 4.7 tmtt? 87.66 24.87 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.311 179.572 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 392' ' ' LYS . . . . . 0.542 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.2 OUTLIER -4.72 116.95 0.02 OUTLIER Pre-proline 0 N--CA 1.473 0.696 0 O-C-N 124.016 0.822 . . . . 0.0 111.962 -179.964 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 393' ' ' PRO . . . . . 0.554 ' CG ' HG21 ' B' ' 420' ' ' ILE . 15.7 Cg_exo -65.35 162.03 35.31 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.351 2.034 . . . . 0.0 112.542 -179.345 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 394' ' ' THR . . . . . 0.456 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 2.3 p -150.08 164.82 34.56 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.478 -0.783 . . . . 0.0 112.022 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -81.6 5.29 18.57 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.603 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 396' ' ' VAL . . . . . 0.591 HG23 ' OD2' ' B' ' 397' ' ' ASP . 26.1 m -123.41 11.54 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 CA-C-O 121.53 0.681 . . . . 0.0 109.462 178.748 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 397' ' ' ASP . . . . . 0.591 ' OD2' HG23 ' B' ' 396' ' ' VAL . 2.0 p30 163.95 59.33 0.0 OUTLIER Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 114.803 -1.089 . . . . 0.0 109.841 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 398' ' ' PRO . . . . . 0.541 ' HB2' ' O ' ' B' ' 418' ' ' ARG . 21.5 Cg_exo -32.91 -57.4 0.31 Allowed 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 123.069 2.513 . . . . 0.0 112.368 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 399' ' ' ASN . . . . . 0.52 ' C ' ' O ' ' B' ' 398' ' ' PRO . 15.7 m120 -5.23 120.77 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 114.948 -1.023 . . . . 0.0 112.256 179.668 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 400' ' ' SER . . . . . 0.512 ' CB ' ' HG3' ' B' ' 393' ' ' PRO . 0.3 OUTLIER -144.15 139.4 28.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.886 179.949 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 401' ' ' ILE . . . . . 1.01 HG23 HG23 ' B' ' 390' ' ' VAL . 1.9 tp -110.34 143.46 20.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.717 -179.537 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 402' ' ' VAL . . . . . 0.68 ' HB ' ' HB2' ' B' ' 427' ' ' ALA . 0.4 OUTLIER -112.78 148.99 15.41 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.651 -179.568 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 403' ' ' GLU . . . . . 0.517 ' OE1' HG11 ' B' ' 411' ' ' VAL . 2.1 mm-40 -127.74 128.72 45.86 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.745 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 404' ' ' CYS . . . . . 0.606 ' HB3' ' HA3' ' B' ' 413' ' ' GLY . 18.7 t -118.85 104.86 10.94 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 177.931 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.571 ' HB2' HG22 ' B' ' 411' ' ' VAL . 3.1 ttp180 -110.96 158.2 19.03 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 124.126 0.891 . . . . 0.0 111.666 -178.3 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 406' ' ' VAL . . . . . 0.683 HG23 ' HB ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -154.7 159.62 3.0 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.668 -179.6 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 64.93 -94.82 0.18 Allowed Glycine 0 CA--C 1.518 0.259 0 CA-C-N 115.173 -0.921 . . . . 0.0 113.211 179.487 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -141.61 20.55 2.19 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 111.555 0.206 . . . . 0.0 111.555 -179.392 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 151.82 -14.46 0.79 Allowed Glycine 0 C--N 1.33 0.195 0 C-N-CA 120.234 -0.984 . . . . 0.0 112.96 179.746 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 410' ' ' THR . . . . . 0.683 ' HB ' HG23 ' B' ' 406' ' ' VAL . 95.0 m -53.58 108.77 0.37 Allowed 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 411' ' ' VAL . . . . . 0.571 HG22 ' HB2' ' B' ' 405' ' ' ARG . 24.2 t -124.07 106.61 17.21 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.742 0 CA-C-O 122.006 0.908 . . . . 0.0 111.523 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.461 ' O ' ' HB3' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -102.62 -38.99 7.26 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 113.704 -1.589 . . . . 0.0 108.942 -179.878 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 413' ' ' GLY . . . . . 0.606 ' HA3' ' HB3' ' B' ' 404' ' ' CYS . . . -72.23 98.64 0.82 Allowed Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.069 -1.062 . . . . 0.0 112.535 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 414' ' ' THR . . . . . . . . . . . . . 3.7 m -134.79 93.68 3.06 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 415' ' ' GLY . . . . . 0.804 ' O ' HD12 ' B' ' 401' ' ' ILE . . . -133.71 147.3 18.99 Favored Glycine 0 C--O 1.226 -0.363 0 C-N-CA 119.523 -1.322 . . . . 0.0 114.394 -178.485 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 10.5 p -127.87 154.1 38.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.312 -0.444 . . . . 0.0 110.173 179.566 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.873 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -165.1 155.72 27.27 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 119.948 -1.12 . . . . 0.0 113.039 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 418' ' ' ARG . . . . . 0.541 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.0 OUTLIER -70.77 -41.98 71.0 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.867 0.365 . . . . 0.0 111.361 -179.939 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 419' ' ' ASN . . . . . 0.808 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.1 OUTLIER -100.36 23.97 9.46 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.184 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 420' ' ' ILE . . . . . 0.759 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 56.51 -43.09 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 179.247 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 421' ' ' LYS . . . . . 0.626 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -45.17 -57.71 3.74 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 179.282 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 422' ' ' ILE . . . . . 0.873 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -45.78 -26.76 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.56 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.601 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.759 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -77.26 -47.92 18.85 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 177.233 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 424' ' ' GLY . . . . . 0.59 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -57.89 -53.48 45.02 Favored Glycine 0 N--CA 1.447 -0.58 0 N-CA-C 110.058 -1.217 . . . . 0.0 110.058 178.079 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 425' ' ' ILE . . . . . 0.479 HG13 ' HB3' ' B' ' 367' ' ' ASP . 0.7 OUTLIER -59.15 -67.67 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 177.653 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 426' ' ' ARG . . . . . 0.567 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 3.5 tpt180 -35.86 -33.76 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.201 179.213 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 427' ' ' ALA . . . . . 0.68 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -63.33 -58.17 7.98 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.512 178.478 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 428' ' ' ALA . . . . . 1.091 ' CB ' HD11 ' B' ' 374' ' ' LEU . . . -58.25 -53.87 53.35 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 178.476 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 429' ' ' GLU . . . . . 0.542 ' HA ' HD21 ' B' ' 432' ' ' LEU . 1.1 tt0 -49.14 -25.02 1.9 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.365 178.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 430' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 2.4 m-80 -78.34 -36.89 45.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.477 179.114 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 431' ' ' ALA . . . . . 0.497 ' O ' ' CE ' ' B' ' 437' ' ' MET . . . -67.73 -41.77 82.94 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.487 -179.372 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 432' ' ' LEU . . . . . 0.827 ' HA ' HD21 ' B' ' 438' ' ' LEU . 0.6 OUTLIER -81.05 6.88 12.24 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.041 -179.839 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.47 -10.75 59.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.711 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 434' ' ' ASP . . . . . 0.501 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 0.8 OUTLIER -126.25 89.95 3.1 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.609 -0.437 . . . . 0.0 112.009 -178.991 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 435' ' ' LYS . . . . . 0.599 ' HA ' HD12 ' B' ' 438' ' ' LEU . 12.4 ptmt -53.79 -51.36 63.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.2 179.198 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 436' ' ' LYS . . . . . 0.561 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -51.95 -36.23 48.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.144 179.834 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 437' ' ' MET . . . . . 0.501 ' HB3' ' HB3' ' B' ' 434' ' ' ASP . 14.9 tmm? -76.75 -50.47 13.5 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.944 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 438' ' ' LEU . . . . . 0.827 HD21 ' HA ' ' B' ' 432' ' ' LEU . 23.0 mt -53.02 -64.04 0.95 Allowed 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.735 0.779 . . . . 0.0 110.162 178.831 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 439' ' ' ASP . . . . . 0.525 ' O ' ' N ' ' B' ' 442' ' ' ALA . 6.1 t70 -50.55 -50.04 54.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.736 179.11 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 440' ' ' PHE . . . . . 0.43 ' HB3' ' O ' ' B' ' 436' ' ' LYS . 0.1 OUTLIER -43.03 -38.58 2.35 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.777 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 441' ' ' TYR . . . . . 0.526 ' O ' ' CG ' ' B' ' 444' ' ' GLN . 48.1 m-85 -74.33 -31.43 62.44 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.863 179.456 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 442' ' ' ALA . . . . . 0.525 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -59.01 -60.65 3.53 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 177.451 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.9 -37.47 19.84 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 178.104 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 444' ' ' GLN . . . . . 0.662 ' HG3' ' N ' ' B' ' 445' ' ' ARG . 0.0 OUTLIER -62.17 -47.14 85.82 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.384 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 445' ' ' ARG . . . . . 0.662 ' N ' ' HG3' ' B' ' 444' ' ' GLN . 0.0 OUTLIER -50.06 -35.1 23.77 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.083 179.589 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -86.63 -39.95 15.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.481 -179.542 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.912 -179.275 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.509 " O2'" " O5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.183 0 O4'-C1'-N19 111.397 3.197 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.597 ' C6 ' ' C5 ' ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.222 0 O4'-C1'-N19 110.982 2.782 . 0.062 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.81 HO2' " C5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.714 0 C3'-C2'-C1' 104.838 3.709 . 0.048 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.81 " C5'" HO2' ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.068 0 O4'-C1'-N19 111.298 3.098 . 0.103 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.5 ' C6 ' " H2'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.189 0 O4'-C1'-N19 111.162 2.962 . 0.091 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.538 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.218 0 O4'-C1'-N19 111.294 3.094 . 0.218 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.673 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.993 0 O4'-C1'-N19 111.313 3.113 . 0.373 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.549 ' N4 ' ' C4 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.286 0 O4'-C1'-N19 110.971 2.771 . 0.241 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.455 " H2'" ' C6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.19 0 O4'-C1'-N19 111.249 3.049 . 0.087 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.642 " O2'" " C5'" ' A' ' 11' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.438 1.97 0 O4'-C1'-N19 111.124 2.924 . 0.369 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.642 " C5'" " O2'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.303 0 O4'-C1'-N19 111.114 2.914 . 0.076 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.781 ' H6 ' " O5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.436 1.802 0 O4'-C1'-N19 111.147 2.947 . 0.017 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.781 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.169 0 O4'-C1'-N19 111.6 3.4 . 0.023 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.705 ' C5 ' ' C8 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -2.041 0 C5'-C4'-C3' 111.191 -2.873 . 0.064 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.705 ' C8 ' ' C5 ' ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.429 -2.033 0 C5'-C4'-C3' 110.685 -3.21 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.7 ' C8 ' ' C6 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.433 -1.65 0 C5'-C4'-C3' 110.762 -3.158 . 0.35 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.567 " O2'" " O4'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.887 0 C5'-C4'-C3' 111.16 -2.893 . 0.0 OUTLIER alpha 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.737 " H2'" " O4'" ' A' ' 19' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.435 1.73 0 C5'-C4'-C3' 110.881 -3.079 . 0.079 2a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.737 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.281 0 O4'-C1'-N19 111.222 3.022 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.868 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 P--O5' 1.609 1.647 0 C5'-C4'-C3' 110.925 -3.05 . 0.264 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.868 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.685 0 C3'-C2'-C1' 104.603 3.448 . 0.012 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.931 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.436 1.852 0 O4'-C1'-N19 111.228 3.028 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.82 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.145 0 C5'-C4'-C3' 111.333 -2.778 . 0.031 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.69 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.36 0 O4'-C1'-N19 111.453 3.253 . 0.185 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . 0.575 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.301 0 O4'-C1'-N19 111.066 2.866 . 0.178 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.575 ' C6 ' ' C6 ' ' A' ' 25' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.569 0 O4'-C1'-N19 111.097 2.897 . 0.117 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.865 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.024 0 O4'-C1'-N19 111.146 2.946 . 0.113 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.865 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.532 0 C3'-C2'-C1' 104.401 3.223 . 0.028 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.916 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.196 0 O4'-C1'-N19 111.254 3.054 . 0.176 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 0.992 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.356 0 O4'-C1'-N19 111.533 3.333 . 0.29 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 0.992 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.597 0 O4'-C1'-N19 111.265 3.065 . 0.202 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . 0.638 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.538 0 C5'-C4'-C3' 111.077 -2.949 . 0.133 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.152 0 N-CA-C 112.547 -0.221 . . . . 0.0 112.547 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -142.17 78.31 1.62 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.769 0.319 . . . . 0.0 110.885 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 366' ' ' LEU . . . . . 0.815 ' O ' HD23 ' B' ' 366' ' ' LEU . 0.3 OUTLIER -159.81 159.92 33.2 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 179.942 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.479 ' O ' ' HG2' ' B' ' 371' ' ' LYS . 21.1 t70 26.12 -96.6 0.01 OUTLIER 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.344 -179.3 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.51 ' HE2' ' N ' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -41.7 -56.24 2.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.553 179.773 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 369' ' ' ASN . . . . . 0.51 ' N ' ' HE2' ' B' ' 368' ' ' MET . 0.6 OUTLIER -62.97 -34.39 77.41 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.829 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 1.021 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -62.59 -72.15 0.14 Allowed 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.852 179.176 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.479 ' HG2' ' O ' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -39.15 -38.18 0.46 Allowed 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.648 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.642 ' CG ' ' N3 ' ' A' ' 18' ' ' ' A' . 0.6 OUTLIER -61.83 -46.47 89.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.234 179.259 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.641 ' NE2' ' HG ' ' B' ' 377' ' ' LEU . 1.3 tm0? -60.98 -59.57 5.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.617 179.315 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 0.572 ' N ' HD23 ' B' ' 374' ' ' LEU . 0.7 OUTLIER -46.36 -69.97 0.11 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.109 -0.951 . . . . 0.0 112.025 -179.464 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 375' ' ' TYR . . . . . 0.523 ' O ' ' N ' ' B' ' 379' ' ' GLY . 1.9 m-85 -72.03 -61.16 1.89 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -177.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.529 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.6 OUTLIER -55.58 -56.88 15.2 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -178.478 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.641 ' HG ' ' NE2' ' B' ' 373' ' ' GLN . 0.2 OUTLIER -72.2 -45.51 60.02 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -178.273 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.78 HG22 HD11 ' B' ' 383' ' ' LEU . 11.3 mm -128.5 39.1 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.317 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' B' ' 375' ' ' TYR . . . -111.21 73.49 0.21 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.415 179.757 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.862 ' CD1' HD12 ' B' ' 383' ' ' LEU . 23.8 p90 -95.01 -164.64 1.19 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.669 0.271 . . . . 0.0 110.865 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 381' ' ' ALA . . . . . 0.575 ' O ' ' CE2' ' B' ' 380' ' ' TYR . . . -97.53 124.54 41.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.369 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 382' ' ' SER . . . . . 0.57 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 1.5 m 94.33 -10.93 0.12 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.97 179.253 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.862 HD12 ' CD1' ' B' ' 380' ' ' TYR . 5.1 tt -45.49 -39.99 7.9 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.112 0.482 . . . . 0.0 110.532 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 13.9 tpt85 67.33 64.76 0.42 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.929 179.314 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.561 ' HA ' HG12 ' B' ' 406' ' ' VAL . 0.1 OUTLIER -58.45 157.46 8.82 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.347 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 386' ' ' HIS . . . . . 0.525 ' CB ' ' O ' ' B' ' 405' ' ' ARG . 0.0 OUTLIER -158.67 72.65 0.6 Allowed 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -178.822 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.578 ' CZ ' ' HB3' ' B' ' 404' ' ' CYS . 5.7 m-85 -86.67 95.56 9.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.849 0.357 . . . . 0.0 110.089 177.135 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 388' ' ' VAL . . . . . 0.567 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -88.66 136.88 22.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.028 -179.7 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.2 m -97.12 126.43 42.29 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.084 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 0.965 HG23 HG23 ' B' ' 401' ' ' ILE . 28.0 m -132.33 153.21 37.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.5 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.545 ' O ' ' C ' ' B' ' 392' ' ' LYS . 6.6 tptt 87.3 21.87 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.501 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.545 ' C ' ' O ' ' B' ' 391' ' ' LYS . 6.7 mttp -8.72 122.41 0.02 OUTLIER Pre-proline 0 N--CA 1.472 0.647 0 O-C-N 123.839 0.712 . . . . 0.0 111.996 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.514 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 23.9 Cg_exo -62.83 163.04 23.17 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.787 2.325 . . . . 0.0 113.447 -178.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 394' ' ' THR . . . . . 0.625 ' OG1' HG22 ' B' ' 396' ' ' VAL . 0.1 OUTLIER -149.65 168.0 24.82 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.337 179.832 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -81.12 7.68 10.49 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.973 0.416 . . . . 0.0 111.159 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 396' ' ' VAL . . . . . 0.625 HG22 ' OG1' ' B' ' 394' ' ' THR . 5.2 m -129.26 13.59 2.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.425 0.631 . . . . 0.0 109.613 178.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 397' ' ' ASP . . . . . 0.523 ' OD1' ' CG2' ' B' ' 394' ' ' THR . 10.5 p30 163.51 63.12 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.382 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.528 ' O ' ' C ' ' B' ' 399' ' ' ASN . 75.9 Cg_exo -39.06 -51.35 2.5 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.852 2.368 . . . . 0.0 112.028 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.528 ' C ' ' O ' ' B' ' 398' ' ' PRO . 10.2 m120 -6.75 123.36 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.027 -0.988 . . . . 0.0 112.385 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 400' ' ' SER . . . . . 0.498 ' HB3' HG22 ' B' ' 420' ' ' ILE . 0.9 OUTLIER -140.49 137.97 34.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.581 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 0.965 HG23 HG23 ' B' ' 390' ' ' VAL . 0.5 OUTLIER -114.26 141.73 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-O 120.995 0.426 . . . . 0.0 111.18 -179.769 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.602 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.3 OUTLIER -107.87 152.41 9.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.277 -179.178 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 0.567 ' CB ' HG23 ' B' ' 388' ' ' VAL . 0.1 OUTLIER -115.63 98.91 6.97 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.217 178.931 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.655 ' O ' HD22 ' B' ' 412' ' ' LEU . 0.0 OUTLIER -78.43 92.32 4.59 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 179.325 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.594 ' HA ' ' O ' ' B' ' 410' ' ' THR . 5.7 ptp180 -139.14 157.45 45.93 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.498 -179.24 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.622 HG13 HD21 ' B' ' 412' ' ' LEU . 2.9 m -148.98 158.86 6.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.826 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 73.62 -1.61 43.96 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.82 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 14.6 t0 76.42 7.97 3.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.695 0.283 . . . . 0.0 111.246 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -157.76 17.61 0.34 Allowed Glycine 0 CA--C 1.519 0.338 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.92 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.753 HG21 ' OH ' ' B' ' 441' ' ' TYR . 0.2 OUTLIER -128.74 122.48 30.74 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 116.54 0.17 . . . . 0.0 111.044 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 36.0 t -113.21 103.45 15.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.602 0.239 . . . . 0.0 110.788 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.82 ' N ' HD13 ' B' ' 412' ' ' LEU . 0.0 OUTLIER -67.79 -25.22 65.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.959 0.409 . . . . 0.0 110.024 179.546 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 413' ' ' GLY . . . . . 0.443 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 165.59 -165.36 37.89 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.313 -0.946 . . . . 0.0 112.843 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.473 ' CG2' ' O ' ' B' ' 402' ' ' VAL . 0.2 OUTLIER -150.68 157.41 42.93 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.657 0.265 . . . . 0.0 110.726 -179.766 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.498 ' HA2' ' HG2' ' B' ' 426' ' ' ARG . . . -149.73 152.29 24.26 Favored Glycine 0 C--O 1.226 -0.396 0 C-N-CA 120.044 -1.074 . . . . 0.0 113.226 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 416' ' ' VAL . . . . . 0.573 ' HB ' HD12 ' B' ' 401' ' ' ILE . 2.7 p -141.4 150.23 19.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.63 0.252 . . . . 0.0 110.898 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.876 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -163.0 161.34 33.81 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.445 -0.883 . . . . 0.0 112.608 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.493 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.0 OUTLIER -74.92 -42.86 56.93 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.807 0.337 . . . . 0.0 111.31 -179.787 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.753 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.7 OUTLIER -98.06 27.32 4.63 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.778 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.721 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 53.44 -44.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 178.903 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.648 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.6 OUTLIER -44.65 -56.8 4.09 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.975 -1.121 . . . . 0.0 107.975 179.867 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.876 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -46.29 -24.96 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.462 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 178.349 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.721 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -79.5 -48.74 13.38 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 177.434 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 424' ' ' GLY . . . . . 0.647 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -58.65 -52.82 50.78 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.284 -1.126 . . . . 0.0 110.284 178.071 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.518 ' N ' HD13 ' B' ' 425' ' ' ILE . 3.3 mm -58.43 -67.22 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 177.638 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.58 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 7.6 tpt180 -36.32 -32.16 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.237 178.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.647 ' HB3' ' O ' ' B' ' 424' ' ' GLY . . . -64.5 -55.13 22.7 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.431 178.553 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 1.021 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -56.88 -55.7 31.11 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.44 178.61 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.663 ' HA ' HD21 ' B' ' 432' ' ' LEU . 0.7 OUTLIER -53.5 -21.3 6.05 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.45 179.148 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.516 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.7 OUTLIER -75.65 -41.32 54.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.257 179.03 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.592 ' O ' HD21 ' B' ' 438' ' ' LEU . . . -67.25 -37.72 83.99 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.753 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.803 HD22 ' HA ' ' B' ' 370' ' ' ALA . 0.7 OUTLIER -83.9 9.57 11.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.716 0.293 . . . . 0.0 111.108 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -92.27 -11.72 34.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.245 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.526 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 32.7 m-20 -109.25 71.71 0.78 Allowed 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 120.687 0.279 . . . . 0.0 111.219 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.57 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -45.84 -54.01 8.79 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.433 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.57 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 7.5 mttt -48.19 -40.46 24.2 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.57 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.674 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.4 OUTLIER -77.73 -41.03 39.15 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 178.973 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.592 HD21 ' O ' ' B' ' 431' ' ' ALA . 95.7 mt -56.17 -65.04 0.67 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.966 179.173 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 439' ' ' ASP . . . . . 0.494 ' O ' ' N ' ' B' ' 442' ' ' ALA . 21.5 t70 -55.92 -46.42 78.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.267 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.497 ' HB2' ' O ' ' B' ' 436' ' ' LYS . 8.2 t80 -41.97 -45.12 3.71 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.28 -0.873 . . . . 0.0 108.903 179.276 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.753 ' OH ' HG21 ' B' ' 410' ' ' THR . 16.6 m-30 -67.62 -37.56 82.67 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.487 178.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 442' ' ' ALA . . . . . 0.494 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -47.61 -61.77 1.77 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 178.285 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.83 -57.34 11.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.643 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.439 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.3 OUTLIER -41.92 -62.88 0.82 Allowed 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.232 0.539 . . . . 0.0 110.36 179.011 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.602 ' HG2' ' CD1' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -43.22 -37.35 2.1 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.819 179.172 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -76.74 -41.05 46.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.919 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 447' ' ' ALA . . . . . 0.47 ' O ' ' O ' ' B' ' 448' ' ' ILE . . . -70.31 -72.07 0.22 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.322 -179.656 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.495 HD11 ' O ' ' B' ' 445' ' ' ARG . 0.1 OUTLIER 27.87 100.23 0.02 OUTLIER Pre-proline 0 N--CA 1.463 0.181 0 CA-C-N 116.031 -0.531 . . . . 0.0 112.029 -179.82 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -71.57 -169.05 0.39 Allowed 'Trans proline' 0 N--CA 1.464 -0.242 0 C-N-CA 122.912 2.408 . . . . 0.0 112.43 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -90.31 172.63 8.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.181 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 23.8 m 60.33 67.3 0.86 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.154 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -126.95 141.32 51.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.635 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 6.2 p . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.265 -0.874 . . . . 0.0 111.033 -179.791 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.762 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.436 1.837 0 C5'-C4'-C3' 111.19 -2.874 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.88 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.193 0 O4'-C1'-N19 111.345 3.145 . 0.326 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.88 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.175 0 O4'-C1'-N19 111.042 2.842 . 0.286 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.638 " C5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.271 0 C5'-C4'-C3' 111.229 -2.848 . 0.079 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.518 ' C6 ' " H2'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.217 0 O4'-C1'-N19 111.266 3.066 . 0.203 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.492 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.239 0 O4'-C1'-N19 111.065 2.865 . 0.153 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.519 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.002 0 O4'-C1'-N19 111.504 3.304 . 0.169 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.632 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.442 2.312 0 O4'-C1'-N19 111.093 2.893 . 0.234 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.632 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.436 0 O4'-C1'-N19 111.111 2.911 . 0.305 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.595 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.437 1.902 0 O4'-C1'-N19 111.338 3.138 . 0.063 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.647 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.426 0 O4'-C1'-N19 111.05 2.85 . 0.058 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.875 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 P--O5' 1.612 1.863 0 C5'-C4'-C3' 111.19 -2.873 . 0.02 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.875 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.578 0 C3'-C2'-C1' 104.67 3.522 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.643 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.491 0 O4'-C1'-N19 111.295 3.095 . 0.209 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.693 ' C6 ' ' N7 ' ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.43 -1.894 0 C5'-C4'-C3' 110.908 -3.061 . 0.035 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.693 ' N7 ' ' C6 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.747 0 C5'-C4'-C3' 110.857 -3.096 . 0.522 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.683 " O2'" ' C8 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.22 0 C5'-C4'-C3' 110.817 -3.122 OUTLIER-EPSILON 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.683 ' C8 ' " O2'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.656 0 C5'-C4'-C3' 110.989 -3.007 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.587 " O2'" " O4'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.12 0 O4'-C1'-N19 111.274 3.074 . 0.186 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.721 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.77 0 O4'-C1'-N19 111.097 2.897 . 0.072 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.888 HO2' ' H6 ' ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.523 0 C3'-C2'-C1' 104.749 3.609 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.914 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.979 0 O4'-C1'-N19 111.317 3.117 . 0.01 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.716 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.211 0 O4'-C1'-N19 111.798 3.598 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.834 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 P--O5' 1.614 2.145 0 C5'-C4'-C3' 111.542 -2.639 . 0.058 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.441 2.289 0 O4'-C1'-N19 111.383 3.183 . 0.381 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.675 HO2' " C5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.449 0 O4'-C1'-N19 111.222 3.022 . 0.162 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.692 ' H6 ' " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.033 0 O4'-C1'-N19 111.166 2.966 . 0.121 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.667 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.411 0 C3'-C2'-C1' 104.435 3.261 . 0.039 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.846 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.442 2.314 0 O4'-C1'-N19 111.133 2.933 . 0.166 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 0.955 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.268 0 O4'-C1'-N19 111.49 3.29 . 0.378 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 0.955 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.665 0 O4'-C1'-N19 111.411 3.211 . 0.224 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . 0.596 " H5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.414 0 C5'-C4'-C3' 111.331 -2.779 . 0.619 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.197 0 N-CA-C 112.493 -0.243 . . . . 0.0 112.493 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 365' ' ' SER . . . . . 0.588 ' HB3' ' P ' ' A' ' 15' ' ' ' A' . 23.1 t -80.69 57.33 2.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.768 0.318 . . . . 0.0 111.062 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 366' ' ' LEU . . . . . 0.496 ' HA ' HD12 ' B' ' 366' ' ' LEU . 2.8 tp -50.9 -19.67 1.08 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.347 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.54 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -45.67 -71.88 0.07 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.354 179.601 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.702 ' HE1' ' HB3' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -38.58 -35.48 0.19 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.14 -179.129 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 369' ' ' ASN . . . . . 0.702 ' HB3' ' HE1' ' B' ' 368' ' ' MET . 0.1 OUTLIER -67.71 -39.38 84.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.027 0.441 . . . . 0.0 109.904 179.779 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 0.58 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -62.27 -69.99 0.22 Allowed 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.134 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.543 ' HE3' ' N ' ' B' ' 368' ' ' MET . 0.4 OUTLIER -37.23 -44.93 0.61 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.13 179.428 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.547 ' O ' ' CB ' ' B' ' 376' ' ' SER . 1.4 tmm_? -56.27 -40.68 74.63 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.897 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.517 ' HA ' ' HB2' ' B' ' 377' ' ' LEU . 0.0 OUTLIER -64.26 -48.51 75.47 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.076 0.465 . . . . 0.0 111.273 179.871 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 0.865 HD13 ' OH ' ' B' ' 387' ' ' TYR . 0.3 OUTLIER -59.72 -70.18 0.17 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -178.128 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 375' ' ' TYR . . . . . 0.553 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 4.6 m-85 -72.51 -34.49 67.65 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -177.218 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.547 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -83.58 -54.96 4.56 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.561 -179.323 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.537 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.2 OUTLIER -72.68 -35.84 67.77 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.625 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.537 HD13 ' O ' ' B' ' 377' ' ' LEU . 3.9 mm -137.01 36.78 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -178.515 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.553 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -127.04 90.71 0.36 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.212 -0.994 . . . . 0.0 112.824 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.687 ' CD2' HD12 ' B' ' 383' ' ' LEU . 52.3 p90 -99.74 -160.08 0.78 Allowed 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.397 -0.223 . . . . 0.0 110.397 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 381' ' ' ALA . . . . . 0.539 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -93.61 123.03 36.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.8 0.333 . . . . 0.0 111.622 -179.61 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 382' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 3.2 m 87.78 -3.66 0.56 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.017 179.03 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.687 HD12 ' CD2' ' B' ' 380' ' ' TYR . 6.2 tt -50.63 -43.67 57.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.807 0.337 . . . . 0.0 111.143 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 384' ' ' ARG . . . . . 0.55 ' O ' HG12 ' B' ' 406' ' ' VAL . 0.1 OUTLIER 69.84 74.09 0.23 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.674 -179.827 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.656 HD21 ' HE1' ' B' ' 387' ' ' TYR . 9.9 tt -118.68 128.95 55.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.124 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 41.1 p-80 -149.51 146.99 27.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.65 0.738 . . . . 0.0 112.85 -178.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.865 ' OH ' HD13 ' B' ' 374' ' ' LEU . 2.8 m-85 -101.66 141.75 34.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.661 -1.154 . . . . 0.0 110.532 178.558 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 388' ' ' VAL . . . . . 0.577 HG23 ' HB3' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -124.27 119.52 56.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.204 0.526 . . . . 0.0 110.777 179.317 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.8 m -80.12 122.99 27.49 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.817 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 0.657 HG23 ' CG2' ' B' ' 401' ' ' ILE . 31.5 m -131.86 161.01 42.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.76 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.785 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.2 OUTLIER 94.65 21.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.424 -179.908 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.533 ' O ' ' O ' ' B' ' 391' ' ' LYS . 0.7 OUTLIER 4.24 118.94 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.741 0 O-C-N 124.095 0.872 . . . . 0.0 112.829 179.742 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.488 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 7.0 Cg_exo -68.58 157.03 63.52 Favored 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.615 2.21 . . . . 0.0 113.586 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 394' ' ' THR . . . . . 0.432 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 0.6 OUTLIER -137.24 171.77 13.99 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.472 -1.24 . . . . 0.0 111.981 -179.624 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -93.39 18.75 9.23 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-O 121.289 0.566 . . . . 0.0 110.442 179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 34.6 m -135.67 -0.53 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.195 178.146 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 397' ' ' ASP . . . . . 0.434 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 1.6 m-20 179.25 56.24 0.06 OUTLIER Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 114.871 -1.059 . . . . 0.0 108.852 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.488 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 73.7 Cg_exo -38.57 -35.75 0.51 Allowed 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 123.282 2.654 . . . . 0.0 112.902 -179.251 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.623 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.4 OUTLIER -30.51 134.3 0.06 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.543 0.687 . . . . 0.0 112.212 -178.208 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 400' ' ' SER . . . . . 0.466 ' OG ' ' HG3' ' B' ' 393' ' ' PRO . 45.8 m -143.24 151.68 40.86 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.338 -179.681 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 0.785 HG22 ' HB2' ' B' ' 391' ' ' LYS . 10.2 tt -109.99 156.12 11.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.962 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.75 ' HB ' ' HB2' ' B' ' 427' ' ' ALA . 0.2 OUTLIER -121.19 152.98 24.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.641 -178.369 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 0.577 ' HB3' HG23 ' B' ' 388' ' ' VAL . 2.8 mt-10 -121.24 122.6 40.29 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.764 178.729 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.607 ' HB3' ' CZ ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -109.97 108.1 18.23 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 179.163 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.504 ' HA ' ' O ' ' B' ' 410' ' ' THR . 1.2 ptm180 -134.58 -170.02 2.46 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.683 0.754 . . . . 0.0 112.713 -178.455 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.895 HG23 ' HB ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -158.64 157.75 3.16 Favored 'Isoleucine or valine' 0 C--O 1.243 0.72 0 CA-C-N 114.492 -1.231 . . . . 0.0 112.003 -178.686 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 59.0 -95.08 0.06 OUTLIER Glycine 0 N--CA 1.448 -0.55 0 CA-C-N 114.737 -1.12 . . . . 0.0 111.957 -179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -167.08 27.1 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.753 0.311 . . . . 0.0 110.366 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 177.08 26.51 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 119.997 -1.097 . . . . 0.0 113.528 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.895 ' HB ' HG23 ' B' ' 406' ' ' VAL . 87.4 m -130.53 109.09 10.42 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 117.168 0.484 . . . . 0.0 110.815 178.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 411' ' ' VAL . . . . . 0.48 ' HA ' ' HA ' ' B' ' 405' ' ' ARG . 74.1 t -101.85 116.09 44.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.654 0.264 . . . . 0.0 110.521 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.763 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -71.58 -35.38 70.53 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.411 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 413' ' ' GLY . . . . . 0.494 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 172.38 -176.07 45.42 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.15 -1.024 . . . . 0.0 112.875 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.44 ' O ' ' CG ' ' B' ' 430' ' ' ASN . 0.5 OUTLIER -145.7 155.94 43.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.728 0.299 . . . . 0.0 111.294 -179.369 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.688 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -149.41 135.48 5.36 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.301 -0.952 . . . . 0.0 112.686 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 416' ' ' VAL . . . . . 0.543 ' HB ' HD12 ' B' ' 401' ' ' ILE . 8.8 p -125.87 152.51 33.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.76 0.314 . . . . 0.0 110.506 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.895 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -159.95 167.24 35.33 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.503 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.535 ' CG ' ' OD1' ' B' ' 419' ' ' ASN . 7.4 ptm180 -71.23 -41.92 69.53 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -179.317 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.697 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.3 OUTLIER -107.28 34.15 3.64 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.673 0.273 . . . . 0.0 110.802 179.575 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.724 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.7 OUTLIER 55.99 -42.57 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 179.292 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.541 ' N ' HG13 ' B' ' 420' ' ' ILE . 0.0 OUTLIER -45.0 -61.47 1.61 Allowed 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 118.954 0.797 . . . . 0.0 109.721 -179.795 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.895 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -45.31 -21.9 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 177.851 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.724 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -86.19 -50.53 6.91 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.595 178.231 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 424' ' ' GLY . . . . . 0.433 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -57.46 -42.52 93.9 Favored Glycine 0 C--N 1.337 0.624 0 C-N-CA 120.083 -1.056 . . . . 0.0 110.998 179.112 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.538 ' N ' ' CD1' ' B' ' 425' ' ' ILE . 0.6 OUTLIER -71.16 -63.38 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.237 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.594 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 12.2 tpt180 -41.37 -31.29 0.23 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.681 178.373 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.75 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -64.51 -60.35 3.24 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.449 178.609 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 0.613 ' O ' HD23 ' B' ' 432' ' ' LEU . . . -57.84 -51.9 67.68 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.809 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.552 ' O ' ' HB2' ' B' ' 433' ' ' ARG . 79.7 mm-40 -55.33 -21.59 15.61 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.079 178.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.53 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.6 OUTLIER -76.71 -38.81 53.7 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.138 178.881 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.654 ' HB3' HD22 ' B' ' 374' ' ' LEU . . . -62.42 -32.68 73.56 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.328 0.585 . . . . 0.0 109.49 179.417 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.775 ' HA ' HD21 ' B' ' 438' ' ' LEU . 0.2 OUTLIER -96.99 3.63 51.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.071 178.709 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 433' ' ' ARG . . . . . 0.552 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 0.0 OUTLIER -89.89 19.72 4.65 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.795 -179.964 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.533 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 15.5 m-20 -136.19 80.67 1.84 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.384 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.576 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.3 OUTLIER -47.18 -57.25 5.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.211 -179.905 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.576 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 2.5 mtmt -49.3 -42.49 41.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.28 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.763 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.5 OUTLIER -70.49 -50.31 39.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.585 179.603 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.775 HD21 ' HA ' ' B' ' 432' ' ' LEU . 85.4 mt -50.78 -59.58 3.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.469 0.652 . . . . 0.0 110.489 179.402 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -59.09 -42.66 90.99 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.47 178.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.505 ' CD1' ' C ' ' B' ' 440' ' ' PHE . 0.1 OUTLIER -42.81 -48.96 5.8 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 179.368 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.518 ' OH ' HG21 ' B' ' 410' ' ' THR . 55.1 m-85 -62.57 -46.3 88.98 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.56 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 442' ' ' ALA . . . . . 0.456 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -39.12 -61.69 0.73 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 178.659 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 1.4 tmtt? -49.47 -49.92 43.47 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 178.379 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.528 ' O ' ' N ' ' B' ' 447' ' ' ALA . 2.1 mt-30 -51.04 -59.01 4.62 Favored 'General case' 0 C--N 1.334 -0.085 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 178.878 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.495 ' HA ' HG12 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -38.1 -41.67 0.6 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.495 178.999 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -69.46 -38.16 77.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.896 179.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 447' ' ' ALA . . . . . 0.528 ' N ' ' O ' ' B' ' 444' ' ' GLN . . . -72.64 -71.46 0.29 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.696 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.511 ' C ' ' O ' ' B' ' 447' ' ' ALA . 1.2 pt -15.14 116.02 0.05 OUTLIER Pre-proline 0 N--CA 1.464 0.266 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.397 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -77.7 93.95 1.08 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.907 2.405 . . . . 0.0 112.334 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -51.4 148.56 4.86 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.969 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -48.37 158.39 0.27 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.014 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -148.15 32.35 0.83 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.732 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.213 -0.898 . . . . 0.0 110.911 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.807 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 C2'--O2' 1.433 1.526 0 C5'-C4'-C3' 110.889 -3.074 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.807 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.279 0 O4'-C1'-N19 111.512 3.312 . 0.027 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.597 " O2'" " O5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.673 0 C3'-C2'-C1' 104.933 3.815 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.597 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.321 0 C5'-C4'-C3' 111.131 -2.913 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.56 " O2'" ' HB2' ' B' ' 393' ' ' PRO . . . . . . . . 0 O4'--C1' 1.441 2.282 0 O4'-C1'-N19 111.221 3.021 . 0.109 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.485 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.576 0 O4'-C1'-N19 110.985 2.785 . 0.06 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.485 ' C6 ' " H2'" ' A' ' 6' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.051 0 O4'-C1'-N19 111.451 3.251 . 0.153 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.639 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.442 2.368 0 O4'-C1'-N19 110.97 2.77 . 0.183 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.639 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.4 0 O4'-C1'-N19 111.083 2.883 . 0.293 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.636 " O2'" " C5'" ' A' ' 11' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.438 2.006 0 O4'-C1'-N19 111.076 2.876 . 0.101 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.636 " C5'" " O2'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.272 0 O4'-C1'-N19 111.077 2.877 . 0.034 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.879 ' H6 ' " O5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.436 1.831 0 O4'-C1'-N19 111.23 3.03 . 0.055 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.772 " O2'" " H5'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.878 0 O4'-C1'-N19 111.161 2.961 . 0.066 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.772 " H5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.636 0 C3'-C2'-C1' 104.083 2.87 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.929 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.311 0 C5'-C4'-C3' 110.966 -3.023 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.929 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -1.981 0 O4'-C1'-N19 111.483 3.283 OUTLIER-DELTA 0.028 1b . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.591 " O2'" " C1'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -2.035 0 C5'-C4'-C3' 110.886 -3.076 . 0.0 OUTLIER alpha 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.652 ' N6 ' ' N3 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.435 1.741 0 O4'-C1'-N19 111.025 2.825 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.875 " O2'" " H5'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.039 0 O4'-C1'-N19 111.238 3.038 . 0.269 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.875 " H5'" " O2'" ' A' ' 19' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.441 0 C3'-C2'-C1' 104.494 3.326 . 0.126 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.55 " O2'" " C5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.43 -1.906 0 C5'-C4'-C3' 110.997 -3.002 . 0.021 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.868 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.436 1.856 0 O4'-C1'-N19 111.144 2.944 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.672 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.261 0 O4'-C1'-N19 111.877 3.677 . 0.065 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.781 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.236 0 C5'-C4'-C3' 111.448 -2.701 . 0.066 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . 0.512 ' O6 ' ' O4 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.237 0 O4'-C1'-N19 111.316 3.116 . 0.426 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.502 " H2'" ' C6 ' ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.494 0 C5'-C4'-C3' 111.183 -2.878 . 0.087 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.869 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 P--O5' 1.613 2.023 0 C5'-C4'-C3' 111.273 -2.818 . 0.153 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.869 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.472 0 C3'-C2'-C1' 104.903 3.781 . 0.013 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.898 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.24 0 O4'-C1'-N19 111.319 3.119 . 0.08 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 0.898 " H5'" " O2'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.342 0 O4'-C1'-N19 111.39 3.19 . 0.437 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 0.849 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.592 0 O4'-C1'-N19 111.476 3.276 . 0.05 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . 0.424 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.765 0 C3'-C2'-C1' 104.342 3.158 . 0.271 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.215 0 N-CA-C 112.494 -0.243 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 54.3 54.23 9.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.917 0.389 . . . . 0.0 110.948 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 366' ' ' LEU . . . . . 0.451 ' HB3' ' HB2' ' B' ' 369' ' ' ASN . 0.1 OUTLIER -119.43 118.02 30.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.906 179.918 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.646 ' HA ' HG23 ' B' ' 425' ' ' ILE . 33.9 t0 -61.04 -61.28 2.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.256 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.476 ' HA ' ' CE ' ' B' ' 371' ' ' LYS . 2.1 tmm? -35.51 -53.61 0.67 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.496 179.586 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 369' ' ' ASN . . . . . 0.451 ' HB2' ' HB3' ' B' ' 366' ' ' LEU . 2.1 m120 -60.19 -45.49 92.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.28 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 1.027 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -61.36 -71.7 0.14 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.244 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.476 ' CE ' ' HA ' ' B' ' 368' ' ' MET . 0.1 OUTLIER -34.94 -50.75 0.49 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.901 0.381 . . . . 0.0 110.473 -179.836 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.575 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.3 OUTLIER -55.56 -41.59 73.5 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.881 179.669 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.666 ' OE1' HD23 ' B' ' 377' ' ' LEU . 0.3 OUTLIER -66.1 -61.06 2.24 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.141 0.496 . . . . 0.0 110.798 179.601 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 1.072 HD11 ' CB ' ' B' ' 428' ' ' ALA . 0.4 OUTLIER -46.79 -73.24 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.577 0.955 . . . . 0.0 113.577 -178.571 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 375' ' ' TYR . . . . . 0.47 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.5 m-85 -92.3 -4.93 53.24 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -176.496 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.575 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -113.72 5.28 16.35 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.078 -0.649 . . . . 0.0 110.66 179.122 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.666 HD23 ' OE1' ' B' ' 373' ' ' GLN . 3.7 tp -144.51 -35.85 0.34 Allowed 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.281 179.579 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.672 HG23 ' CB ' ' B' ' 441' ' ' TYR . 5.5 mm -135.36 38.21 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -179.595 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.569 ' HA2' HD21 ' B' ' 383' ' ' LEU . . . -149.81 68.18 0.34 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.591 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.712 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 15.1 p90 -74.97 -50.9 15.09 Favored 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 121.071 -0.251 . . . . 0.0 110.696 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 381' ' ' ALA . . . . . 0.712 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 158.04 -14.75 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 178.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 382' ' ' SER . . . . . 0.438 ' HG ' ' HE2' ' B' ' 380' ' ' TYR . 0.5 OUTLIER -124.0 31.69 5.76 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -178.456 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.569 HD21 ' HA2' ' B' ' 379' ' ' GLY . 0.1 OUTLIER -101.0 -8.92 21.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.855 0.359 . . . . 0.0 110.537 178.703 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 57.4 44.05 22.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.145 -0.479 . . . . 0.0 109.95 -179.441 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.833 ' HA ' HG12 ' B' ' 406' ' ' VAL . 9.8 tt -90.96 125.84 35.9 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 386' ' ' HIS . . . . . 0.514 ' O ' ' O ' ' B' ' 405' ' ' ARG . 2.3 p-80 -144.96 148.89 34.31 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 -178.525 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.436 ' CE1' HD21 ' B' ' 385' ' ' LEU . 18.2 m-85 -109.63 148.91 30.49 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.738 -1.119 . . . . 0.0 109.549 177.765 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 388' ' ' VAL . . . . . 0.826 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -125.18 125.44 69.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.149 0.5 . . . . 0.0 110.699 179.44 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 389' ' ' THR . . . . . 0.522 ' O ' ' CG2' ' B' ' 389' ' ' THR . 0.5 OUTLIER -83.84 117.0 23.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.453 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 0.921 HG23 HG23 ' B' ' 401' ' ' ILE . 33.9 m -130.52 146.74 33.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.156 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.561 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.3 OUTLIER 94.0 19.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.092 -179.812 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.516 ' C ' ' O ' ' B' ' 391' ' ' LYS . 6.4 mttt -6.27 108.32 0.03 OUTLIER Pre-proline 0 N--CA 1.469 0.479 0 O-C-N 123.952 0.782 . . . . 0.0 112.579 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.56 ' HB2' " O2'" ' A' ' 5' ' ' ' U' . 5.5 Cg_exo -47.51 157.14 0.9 Allowed 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 122.661 2.241 . . . . 0.0 113.195 -179.55 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 394' ' ' THR . . . . . 0.486 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 1.3 p -150.35 164.95 34.51 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.934 -1.03 . . . . 0.0 111.429 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -78.18 5.93 9.18 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.842 0.353 . . . . 0.0 111.297 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 396' ' ' VAL . . . . . 0.492 ' O ' ' HB2' ' B' ' 397' ' ' ASP . 4.3 m -132.1 12.84 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.454 0.645 . . . . 0.0 109.352 178.629 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 397' ' ' ASP . . . . . 0.492 ' HB2' ' O ' ' B' ' 396' ' ' VAL . 32.1 t70 172.56 56.82 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.153 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.494 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 1.5 Cg_endo -44.41 -61.09 0.63 Allowed 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 123.253 2.635 . . . . 0.0 111.856 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.565 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 11.7 p30 -22.72 137.04 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.899 -1.046 . . . . 0.0 112.221 -179.212 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 45.9 t -140.57 154.78 46.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.945 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 0.921 HG23 HG23 ' B' ' 390' ' ' VAL . 0.4 OUTLIER -116.72 142.88 28.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.317 -179.742 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.716 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -107.4 156.35 7.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.666 -179.764 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 0.826 ' CB ' HG23 ' B' ' 388' ' ' VAL . 0.0 OUTLIER -121.6 110.48 16.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.258 179.114 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.802 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 5.7 t -90.5 100.09 12.99 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.855 179.479 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.514 ' O ' ' O ' ' B' ' 386' ' ' HIS . 6.3 ptm180 -143.25 161.99 36.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.392 0.615 . . . . 0.0 111.889 -178.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.833 HG12 ' HA ' ' B' ' 385' ' ' LEU . 5.3 m -142.13 151.01 18.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.289 179.648 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 71.32 3.58 53.67 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.02 -1.086 . . . . 0.0 112.081 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 69.28 21.96 6.85 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.737 0.304 . . . . 0.0 110.78 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -146.25 -46.66 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.424 -0.893 . . . . 0.0 113.182 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.49 ' O ' ' HB2' ' B' ' 405' ' ' ARG . 69.0 m -80.41 125.77 30.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.863 0.364 . . . . 0.0 111.669 -179.365 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 52.9 t -107.88 104.15 16.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.908 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.663 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.1 OUTLIER -61.47 -26.07 67.65 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.586 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 160.02 -154.14 25.16 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.466 -0.788 . . . . 0.0 112.3 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.598 ' OG1' HD11 ' B' ' 401' ' ' ILE . 4.6 t -163.25 162.8 25.47 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.108 0.48 . . . . 0.0 111.797 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.55 ' CA ' ' HG2' ' B' ' 426' ' ' ARG . . . -148.04 151.06 23.34 Favored Glycine 0 C--O 1.224 -0.509 0 C-N-CA 120.343 -0.932 . . . . 0.0 113.148 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 416' ' ' VAL . . . . . 0.674 ' HB ' HD12 ' B' ' 401' ' ' ILE . 5.5 p -142.8 149.6 18.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.728 0.299 . . . . 0.0 110.992 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.94 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -161.3 170.49 37.09 Favored Glycine 0 C--O 1.227 -0.334 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.345 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.519 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 0.0 OUTLIER -81.95 -44.0 17.33 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 116.903 0.351 . . . . 0.0 111.411 179.951 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.743 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.2 OUTLIER -99.99 37.08 1.7 Allowed 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 179.52 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.718 HD12 ' C ' ' B' ' 420' ' ' ILE . 0.6 OUTLIER 48.27 -46.47 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 N-CA-C 115.2 1.556 . . . . 0.0 115.2 178.468 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.706 ' N ' HD12 ' B' ' 420' ' ' ILE . 0.0 OUTLIER -43.3 -56.5 3.48 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -179.51 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.94 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -47.37 -22.26 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.887 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.716 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -83.17 -46.65 12.48 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 177.116 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 424' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -58.94 -51.5 58.82 Favored Glycine 0 C--N 1.334 0.431 0 N-CA-C 110.271 -1.131 . . . . 0.0 110.271 177.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.826 ' N ' HD13 ' B' ' 425' ' ' ILE . 0.9 OUTLIER -61.5 -66.33 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 177.893 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.595 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 7.0 tpt180 -39.02 -32.93 0.1 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.551 179.167 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' B' ' 424' ' ' GLY . . . -62.88 -57.67 10.03 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 178.422 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 1.072 ' CB ' HD11 ' B' ' 374' ' ' LEU . . . -58.24 -53.78 54.44 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.235 178.317 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.676 ' HA ' HD21 ' B' ' 432' ' ' LEU . 0.5 OUTLIER -54.47 -17.33 3.03 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.936 179.229 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.501 ' OD1' ' N ' ' B' ' 414' ' ' THR . 1.1 m-80 -81.77 -36.75 28.14 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 178.436 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.802 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -68.4 -39.43 81.68 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.349 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.752 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.8 OUTLIER -83.24 10.27 8.81 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.85 0.357 . . . . 0.0 111.013 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -86.95 -8.11 57.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.455 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.439 ' O ' ' HG ' ' B' ' 438' ' ' LEU . 1.1 m-20 -117.8 80.52 1.52 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.655 -179.381 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.569 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 1.9 ptpp? -49.68 -54.32 19.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.242 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.569 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -50.35 -39.01 45.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.098 0.475 . . . . 0.0 110.203 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.663 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.8 OUTLIER -76.52 -40.96 48.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.811 178.927 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.752 HD11 ' HA ' ' B' ' 432' ' ' LEU . 83.4 mt -58.36 -64.54 0.89 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.985 179.156 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -49.88 -43.35 49.29 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 178.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.486 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -45.32 -42.49 9.91 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.382 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.672 ' CB ' HG23 ' B' ' 378' ' ' ILE . 41.8 m-85 -66.62 -45.78 77.96 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.858 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 442' ' ' ALA . . . . . 0.435 ' O ' ' HB2' ' B' ' 445' ' ' ARG . . . -41.99 -59.74 1.64 Allowed 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.552 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -49.92 -44.59 50.43 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 178.138 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.518 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -63.12 -12.09 24.86 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.65 179.318 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.728 ' O ' HD11 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -90.41 -36.85 14.35 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.821 -179.746 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -85.74 -37.4 19.39 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.939 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 447' ' ' ALA . . . . . 0.446 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -59.23 -53.38 58.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.801 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.728 HD11 ' O ' ' B' ' 445' ' ' ARG . 1.1 pt -29.77 105.51 0.22 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.814 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_exo -51.62 -167.39 0.0 OUTLIER 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.922 2.414 . . . . 0.0 112.36 179.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 450' ' ' ARG . . . . . 0.429 ' C ' ' OG ' ' B' ' 451' ' ' SER . 0.6 OUTLIER -177.37 -50.53 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.139 179.86 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 451' ' ' SER . . . . . 0.429 ' OG ' ' C ' ' B' ' 450' ' ' ARG . 0.0 OUTLIER 179.86 -175.78 0.3 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.914 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 452' ' ' GLU . . . . . 0.418 ' O ' ' C ' ' B' ' 453' ' ' SER . 6.0 mt-10 65.26 76.4 0.33 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.888 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 453' ' ' SER . . . . . 0.418 ' C ' ' O ' ' B' ' 452' ' ' GLU . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.337 -0.84 . . . . 0.0 111.014 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.587 " O2'" " O5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.785 0 C3'-C2'-C1' 104.377 3.197 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.943 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.163 0 O4'-C1'-N19 111.484 3.284 . 0.061 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.943 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.176 0 O4'-C1'-N19 111.315 3.115 . 0.088 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.523 " H2'" ' C6 ' ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.197 0 O4'-C1'-N19 111.473 3.273 . 0.239 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.778 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.022 0 O4'-C1'-N19 111.165 2.965 . 0.023 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.518 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.255 0 O4'-C1'-N19 111.161 2.961 . 0.144 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.762 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.952 0 O4'-C1'-N19 111.615 3.415 . 0.292 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.676 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.153 0 O4'-C1'-N19 110.952 2.752 . 0.148 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.676 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.231 0 O4'-C1'-N19 111.239 3.039 . 0.068 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.9 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 P--O5' 1.611 1.837 0 O4'-C1'-N19 111.247 3.047 . 0.064 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.582 " O2'" " O5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.35 0 O4'-C1'-N19 111.165 2.965 . 0.028 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.803 ' H6 ' " O5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 P--O5' 1.611 1.823 0 O4'-C1'-N19 111.14 2.94 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.792 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.641 0 C3'-C2'-C1' 104.692 3.547 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.651 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.454 0 O4'-C1'-N19 111.35 3.15 . 0.037 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.859 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.428 -2.045 0 C5'-C4'-C3' 110.849 -3.101 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.859 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.432 -1.745 0 O4'-C1'-N19 111.775 3.575 . 0.0 OUTLIER alpha 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.71 ' N7 ' H5'' ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.429 -1.986 0 C5'-C4'-C3' 110.776 -3.149 OUTLIER-EPSILON 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.709 ' P ' " O2'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.716 0 C5'-C4'-C3' 110.967 -3.022 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.704 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.269 0 O4'-C1'-N19 111.298 3.098 . 0.012 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.741 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.436 1.836 0 C5'-C4'-C3' 111.217 -2.855 . 0.149 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.741 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.389 0 C5'-C4'-C3' 110.851 -3.099 . 0.31 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.854 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.003 0 O4'-C1'-N19 111.098 2.898 . 0.09 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.817 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.228 0 O4'-C1'-N19 111.812 3.612 . 0.034 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.779 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.042 0 O4'-C1'-N19 110.88 2.68 . 0.082 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.441 2.242 0 O4'-C1'-N19 111.238 3.038 . 0.444 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.49 " H2'" ' C6 ' ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.44 0 O4'-C1'-N19 111.129 2.929 . 0.166 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.91 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.179 0 O4'-C1'-N19 111.169 2.969 . 0.302 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.91 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.414 0 C3'-C2'-C1' 104.333 3.148 . 0.121 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.719 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.125 0 C5'-C4'-C3' 111.258 -2.828 . 0.171 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 1.048 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.159 0 O4'-C1'-N19 111.572 3.372 . 0.378 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 1.048 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.527 0 O4'-C1'-N19 111.232 3.032 . 0.245 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.39 0 O4'-C1'-N19 111.139 2.939 . 0.43 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.139 0 N-CA-C 112.55 -0.22 . . . . 0.0 112.55 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 14.8 m 59.97 59.68 2.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.903 0.382 . . . . 0.0 110.746 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 366' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -138.32 132.93 32.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.017 -179.801 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.544 ' HB3' ' CG1' ' B' ' 425' ' ' ILE . 0.3 OUTLIER -54.67 -68.48 0.18 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 179.44 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.544 ' N ' ' HE2' ' B' ' 371' ' ' LYS . 12.5 tmm? -34.84 -45.59 0.26 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.491 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -62.57 -44.41 96.39 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.872 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 0.755 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -60.36 -69.68 0.21 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 179.424 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.544 ' HE2' ' N ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -34.13 -51.02 0.42 Allowed 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.509 179.894 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.559 ' O ' ' CB ' ' B' ' 376' ' ' SER . 2.3 tmm_? -56.96 -40.05 75.76 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.783 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.62 ' NE2' ' HG ' ' B' ' 377' ' ' LEU . 1.1 tm0? -62.28 -59.03 5.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.121 0.486 . . . . 0.0 110.322 178.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 0.759 HD21 HD23 ' B' ' 432' ' ' LEU . 1.7 mt -47.56 -72.65 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.3 -0.864 . . . . 0.0 113.162 -178.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 375' ' ' TYR . . . . . 0.456 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 24.9 m-85 -74.18 -48.45 29.04 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 -176.817 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.559 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -63.25 -54.6 34.7 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.652 -178.576 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.62 ' HG ' ' NE2' ' B' ' 373' ' ' GLN . 0.2 OUTLIER -71.78 -43.85 65.0 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -178.331 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.595 HG22 HD13 ' B' ' 383' ' ' LEU . 8.7 mm -114.59 -58.98 3.34 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -177.648 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.456 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -63.56 66.44 0.04 OUTLIER Glycine 0 CA--C 1.516 0.131 0 C-N-CA 121.14 -0.553 . . . . 0.0 113.117 -179.123 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.683 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 10.4 p90 -49.01 -35.45 15.43 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 111.567 0.21 . . . . 0.0 111.567 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 381' ' ' ALA . . . . . 0.683 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 151.48 -10.31 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.586 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 382' ' ' SER . . . . . 0.43 ' O ' ' OH ' ' B' ' 380' ' ' TYR . 0.3 OUTLIER -147.43 50.85 1.07 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.916 0.389 . . . . 0.0 110.426 179.715 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.612 HD12 ' HE1' ' B' ' 380' ' ' TYR . 0.8 OUTLIER -106.13 -15.67 14.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.793 -179.961 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 384' ' ' ARG . . . . . 0.513 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 0.2 OUTLIER 65.89 60.6 0.67 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.111 179.808 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.89 ' HG ' HG12 ' B' ' 406' ' ' VAL . 2.6 tt -105.67 124.62 49.85 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 386' ' ' HIS . . . . . 0.544 ' O ' ' O ' ' B' ' 405' ' ' ARG . 15.2 p-80 -144.0 148.27 35.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.612 0.72 . . . . 0.0 112.746 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.621 ' OH ' HD13 ' B' ' 374' ' ' LEU . 35.3 m-85 -107.23 144.69 33.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.388 -0.823 . . . . 0.0 111.266 179.077 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 388' ' ' VAL . . . . . 0.685 HG23 ' HB3' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -125.83 125.92 69.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.762 179.332 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.1 m -88.01 122.43 31.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.209 -179.37 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 0.912 HG23 HG23 ' B' ' 401' ' ' ILE . 18.2 m -125.1 157.64 33.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.192 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.618 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.2 OUTLIER 89.56 24.07 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.197 179.954 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.52 ' C ' ' O ' ' B' ' 391' ' ' LYS . 8.2 mmpt? 5.44 108.51 0.01 OUTLIER Pre-proline 0 N--CA 1.471 0.605 0 O-C-N 123.938 0.774 . . . . 0.0 112.317 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.486 ' HD2' ' HA ' ' B' ' 392' ' ' LYS . 3.3 Cg_endo -51.31 162.57 1.29 Allowed 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.709 2.273 . . . . 0.0 113.891 -179.119 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 2.5 p -126.58 160.2 31.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.573 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -91.78 20.35 5.68 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-O 121.316 0.579 . . . . 0.0 110.573 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 396' ' ' VAL . . . . . 0.937 HG12 " O2'" ' A' ' 30' ' ' ' C' . 23.1 m -138.32 13.52 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.323 177.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 397' ' ' ASP . . . . . 0.47 ' O ' ' N ' ' B' ' 399' ' ' ASN . 0.7 OUTLIER 159.23 64.28 0.0 OUTLIER Pre-proline 0 N--CA 1.451 -0.392 0 CA-C-N 114.659 -1.155 . . . . 0.0 108.79 -179.238 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.518 ' O ' ' C ' ' B' ' 399' ' ' ASN . 83.4 Cg_exo -37.34 -23.2 0.05 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.322 0 C-N-CA 123.63 2.886 . . . . 0.0 113.676 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.518 ' C ' ' O ' ' B' ' 398' ' ' PRO . 52.5 m-80 -20.57 109.4 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.271 0 O-C-N 123.537 0.523 . . . . 0.0 111.537 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 38.1 t -131.78 146.3 52.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.256 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 0.912 HG23 HG23 ' B' ' 390' ' ' VAL . 0.0 OUTLIER -108.29 151.76 10.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.37 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.696 ' HB ' ' HB2' ' B' ' 427' ' ' ALA . 0.2 OUTLIER -119.45 157.93 21.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.781 -178.692 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 0.685 ' HB3' HG23 ' B' ' 388' ' ' VAL . 0.7 OUTLIER -121.34 118.31 29.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.741 178.895 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.546 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -93.09 98.53 11.38 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.222 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.549 ' HA ' ' O ' ' B' ' 410' ' ' THR . 1.0 OUTLIER -133.69 158.2 43.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.348 0.594 . . . . 0.0 112.033 -178.291 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.994 HG13 HD21 ' B' ' 412' ' ' LEU . 2.6 m -138.88 178.65 3.77 Favored 'Isoleucine or valine' 0 C--O 1.238 0.463 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.234 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 407' ' ' GLY . . . . . 0.457 ' O ' ' HG2' ' B' ' 384' ' ' ARG . . . 64.77 -92.55 0.13 Allowed Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.898 -0.667 . . . . 0.0 112.375 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -163.64 25.94 0.08 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.902 0.382 . . . . 0.0 110.588 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 409' ' ' GLY . . . . . 0.474 ' HA2' ' NE ' ' B' ' 405' ' ' ARG . . . 163.66 -12.56 0.09 OUTLIER Glycine 0 CA--C 1.522 0.477 0 C-N-CA 120.445 -0.883 . . . . 0.0 113.643 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.549 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 42.4 m -71.8 134.24 46.03 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 117.531 0.665 . . . . 0.0 110.646 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 411' ' ' VAL . . . . . 0.566 HG13 ' OE1' ' B' ' 403' ' ' GLU . 80.3 t -119.18 114.11 43.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.742 0.306 . . . . 0.0 111.733 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.994 HD21 HG13 ' B' ' 406' ' ' VAL . 0.2 OUTLIER -75.29 -32.45 61.0 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.145 179.024 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 413' ' ' GLY . . . . . 0.457 ' O ' ' SG ' ' B' ' 404' ' ' CYS . . . 174.4 -168.74 41.58 Favored Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.003 -1.094 . . . . 0.0 113.319 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.504 ' OG1' HD11 ' B' ' 401' ' ' ILE . 0.1 OUTLIER -146.42 158.46 43.89 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.572 -0.314 . . . . 0.0 111.612 -179.161 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.586 ' CA ' ' CG ' ' B' ' 426' ' ' ARG . . . -152.06 138.11 6.3 Favored Glycine 0 C--O 1.225 -0.418 0 C-N-CA 120.451 -0.881 . . . . 0.0 112.833 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 416' ' ' VAL . . . . . 0.431 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 12.9 p -119.63 150.3 22.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 179.402 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.797 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -159.73 148.6 17.42 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.267 -0.968 . . . . 0.0 112.262 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.487 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 4.3 ptt85 -67.51 -42.47 82.78 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.788 0.327 . . . . 0.0 111.434 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.806 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.1 OUTLIER -100.3 26.74 6.26 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.959 179.358 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.795 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 55.14 -46.21 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 179.597 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.516 ' O ' ' N ' ' B' ' 424' ' ' GLY . 0.0 OUTLIER -44.53 -58.51 2.95 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 119.913 -0.715 . . . . 0.0 109.239 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.806 HD11 ' H ' ' B' ' 419' ' ' ASN . 0.1 OUTLIER -46.0 -27.92 0.75 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.426 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 177.563 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.795 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -70.97 -51.09 27.71 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 176.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 424' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -61.11 -44.2 98.46 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.23 -0.986 . . . . 0.0 111.474 178.676 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.681 ' N ' HD12 ' B' ' 425' ' ' ILE . 1.4 mp -81.63 -3.45 6.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 120.715 0.293 . . . . 0.0 111.391 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.612 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -96.71 -29.67 13.66 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 176.839 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.696 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -69.95 -42.58 73.04 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.531 -1.285 . . . . 0.0 107.531 176.783 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 0.755 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -63.13 -56.93 12.6 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' B' ' 425' ' ' ILE . 0.0 OUTLIER -51.41 -22.06 2.73 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.574 178.231 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.47 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.9 OUTLIER -79.47 -39.25 32.65 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.955 179.166 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.766 ' O ' HD21 ' B' ' 438' ' ' LEU . . . -67.25 -30.42 70.32 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.146 -179.281 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.969 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.2 OUTLIER -95.47 8.24 43.85 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.877 179.772 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.73 -17.23 36.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.077 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.558 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 0.7 OUTLIER -102.85 82.94 2.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.163 -179.12 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.569 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 12.0 ptmt -52.15 -54.69 27.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.924 0.392 . . . . 0.0 110.053 179.602 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.569 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 1.5 mmpt? -51.73 -42.67 62.48 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.59 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.974 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.2 OUTLIER -71.78 -48.99 42.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.004 0.43 . . . . 0.0 110.145 179.188 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.969 HD11 ' HA ' ' B' ' 432' ' ' LEU . 83.1 mt -52.97 -60.9 2.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.433 0.635 . . . . 0.0 110.019 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 439' ' ' ASP . . . . . 0.519 ' O ' ' N ' ' B' ' 442' ' ' ALA . 29.1 t70 -56.01 -44.35 78.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.264 -0.88 . . . . 0.0 108.897 178.647 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.482 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.6 OUTLIER -43.38 -45.01 5.96 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 179.343 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.54 ' HB3' HG23 ' B' ' 378' ' ' ILE . 45.5 m-85 -64.85 -39.42 93.53 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.936 178.368 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 442' ' ' ALA . . . . . 0.519 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -45.34 -62.54 1.22 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.069 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -45.87 -48.92 15.89 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 178.272 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.499 ' HB2' ' O ' ' B' ' 441' ' ' TYR . 0.2 OUTLIER -50.2 -54.58 19.94 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.037 178.148 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.604 ' HG2' ' CD1' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -41.71 -42.77 2.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.13 179.048 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -72.42 -38.0 68.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.286 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 447' ' ' ALA . . . . . 0.491 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -66.85 -64.05 0.93 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.022 -179.205 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.555 ' CG1' ' O ' ' B' ' 445' ' ' ARG . 0.9 OUTLIER -20.87 95.92 0.05 OUTLIER Pre-proline 0 C--N 1.333 -0.149 0 O-C-N 123.766 0.667 . . . . 0.0 112.115 -179.936 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_exo -40.68 -56.74 1.5 Allowed 'Trans proline' 0 N--CA 1.462 -0.337 0 C-N-CA 122.888 2.392 . . . . 0.0 112.593 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.77 141.19 20.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.85 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 12.9 p -69.77 106.11 3.0 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.772 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -57.28 -29.38 63.81 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.802 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 4.3 t . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.213 -0.899 . . . . 0.0 110.932 179.903 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.814 ' H8 ' " O5'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.433 1.558 0 O4'-C1'-N19 111.185 2.985 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.599 ' C6 ' ' C5 ' ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.246 0 O4'-C1'-N19 111.361 3.161 . 0.215 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.629 " O2'" " C5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.569 0 C5'-C4'-C3' 111.377 -2.749 . 0.13 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.629 " C5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.238 0 C5'-C4'-C3' 111.223 -2.851 . 0.122 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.546 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.114 0 O4'-C1'-N19 111.238 3.038 . 0.13 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.519 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.401 0 O4'-C1'-N19 111.203 3.003 . 0.058 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.679 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.054 0 O4'-C1'-N19 111.482 3.282 . 0.131 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.504 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.442 2.327 0 O4'-C1'-N19 111.055 2.855 . 0.262 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.504 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.322 0 O4'-C1'-N19 111.091 2.891 . 0.094 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.776 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 1.959 0 C5'-C4'-C3' 110.935 -3.043 . 0.3 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.651 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.195 0 O4'-C1'-N19 111.127 2.927 . 0.053 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.746 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.437 1.917 0 O4'-C1'-N19 111.311 3.111 . 0.025 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.746 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.428 -2.049 0 O4'-C1'-N19 111.335 3.135 . 0.027 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.654 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.139 0 C5'-C4'-C3' 111.163 -2.891 . 0.057 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.631 " O2'" ' N1 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.431 -1.797 0 C5'-C4'-C3' 110.882 -3.079 . 0.225 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.611 " H4'" ' OP2' ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.431 -1.863 0 C5'-C4'-C3' 110.743 -3.171 OUTLIER-EPSILON 0.051 1b . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.766 " H1'" ' OP1' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.363 0 C5'-C4'-C3' 110.686 -3.209 OUTLIER-EPSILON 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.766 ' OP1' " H1'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 P--O5' 1.612 1.865 0 O4'-C1'-N19 111.336 3.136 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.654 ' C4 ' ' NH2' ' B' ' 372' ' ' ARG . . . . . . . . 0 O4'--C1' 1.439 2.119 0 O4'-C1'-N19 111.26 3.06 . 0.077 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.864 " H2'" " O4'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.434 1.672 0 C5'-C4'-C3' 110.979 -3.014 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.864 " O4'" " H2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.441 0 C5'-C4'-C3' 110.796 -3.136 . 0.033 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.858 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.921 0 C5'-C4'-C3' 111.142 -2.905 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.815 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.309 0 O4'-C1'-N19 111.564 3.364 . 0.043 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.775 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 P--O5' 1.615 2.163 0 C5'-C4'-C3' 111.332 -2.779 . 0.074 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.443 2.408 0 O4'-C1'-N19 111.372 3.172 . 0.356 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.418 " H2'" ' C6 ' ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.326 0 O4'-C1'-N19 111.351 3.151 . 0.111 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.708 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.101 0 O4'-C1'-N19 111.149 2.949 . 0.175 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.708 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.283 0 C5'-C4'-C3' 111.002 -2.999 . 0.078 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.745 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.243 0 O4'-C1'-N19 111.179 2.979 . 0.136 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 0.955 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.356 0 O4'-C1'-N19 111.453 3.253 . 0.077 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 0.955 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.661 0 C3'-C2'-C1' 104.243 3.047 . 0.149 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . 0.566 " H5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.528 0 O4'-C1'-N19 111.225 3.025 . 0.448 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.24 0 N-CA-C 112.363 -0.295 . . . . 0.0 112.363 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 365' ' ' SER . . . . . 0.467 ' O ' ' SD ' ' B' ' 368' ' ' MET . 0.8 OUTLIER -136.9 57.57 1.76 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.805 0.336 . . . . 0.0 110.826 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 366' ' ' LEU . . . . . 0.501 ' O ' ' HB2' ' B' ' 369' ' ' ASN . 7.5 mt -45.0 -24.24 0.21 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.352 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.8 ' HA ' HG23 ' B' ' 425' ' ' ILE . 0.0 OUTLIER -45.75 -71.92 0.07 Allowed 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 178.844 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.603 ' CE ' ' ND2' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -34.37 -44.61 0.2 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.558 179.311 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 369' ' ' ASN . . . . . 0.603 ' ND2' ' CE ' ' B' ' 368' ' ' MET . 4.5 m-20 -56.33 -52.18 65.51 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.916 0.388 . . . . 0.0 110.529 179.25 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 0.802 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -61.22 -70.7 0.17 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.67 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.453 ' HG2' " O2'" ' A' ' 20' ' ' ' A' . 0.3 OUTLIER -36.6 -38.82 0.18 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.134 0.493 . . . . 0.0 110.428 179.924 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.655 ' CZ ' ' C2 ' ' A' ' 18' ' ' ' A' . 0.0 OUTLIER -65.34 -42.32 92.98 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.883 179.799 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.646 ' HG2' HD22 ' B' ' 377' ' ' LEU . 0.1 OUTLIER -59.14 -44.75 92.07 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.583 0.706 . . . . 0.0 110.264 179.136 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 374' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -58.68 -69.77 0.18 Allowed 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 -178.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 375' ' ' TYR . . . . . 0.485 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 5.2 m-30 -96.67 12.03 33.28 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -176.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.759 ' O ' HD12 ' B' ' 377' ' ' LEU . 0.7 OUTLIER -129.81 -1.3 4.78 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.571 179.268 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.759 HD12 ' O ' ' B' ' 376' ' ' SER . 8.8 mp -140.25 -27.52 0.75 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.279 178.646 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.753 HD13 ' O ' ' B' ' 377' ' ' LEU . 4.5 mm -144.38 39.25 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.169 0 CA-C-O 120.644 0.259 . . . . 0.0 111.536 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.485 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -121.72 97.41 0.61 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.895 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.575 ' CE1' ' HB2' ' B' ' 383' ' ' LEU . 46.4 p90 -124.11 -172.98 2.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.639 0.257 . . . . 0.0 110.634 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 381' ' ' ALA . . . . . 0.505 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -96.36 83.17 3.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.42 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 382' ' ' SER . . . . . 0.505 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 3.2 t 157.7 -34.8 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.103 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.701 HD23 ' O ' ' B' ' 383' ' ' LEU . 1.2 tt -45.84 -42.18 12.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.744 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 384' ' ' ARG . . . . . 0.497 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 0.9 OUTLIER 62.55 59.58 1.47 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.761 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.778 ' HG ' HG12 ' B' ' 406' ' ' VAL . 7.0 tt -101.32 132.64 46.76 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.869 -179.515 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 386' ' ' HIS . . . . . 0.459 ' O ' ' O ' ' B' ' 405' ' ' ARG . 24.9 p-80 -149.78 151.9 34.32 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.3 0.572 . . . . 0.0 112.419 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.661 ' HE1' HD21 ' B' ' 385' ' ' LEU . 7.1 m-85 -107.26 150.01 27.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.009 178.402 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 388' ' ' VAL . . . . . 0.791 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -132.42 129.88 59.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.0 179.463 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.3 m -92.31 124.29 36.26 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.661 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 1.097 HG23 HG23 ' B' ' 401' ' ' ILE . 24.2 m -128.3 158.01 40.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.161 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.544 ' HB2' HG22 ' B' ' 401' ' ' ILE . 4.0 tptp 85.82 23.34 0.08 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.67 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.523 ' C ' ' O ' ' B' ' 391' ' ' LYS . 64.2 mmtt -1.29 119.63 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.693 0 O-C-N 124.104 0.877 . . . . 0.0 112.475 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.492 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 17.8 Cg_exo -63.1 159.9 36.72 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.565 2.177 . . . . 0.0 113.077 -179.482 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 394' ' ' THR . . . . . 0.487 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 3.1 p -151.79 167.84 26.96 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.621 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -84.67 10.83 10.2 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.161 0.505 . . . . 0.0 110.73 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 396' ' ' VAL . . . . . 0.449 ' O ' ' CB ' ' B' ' 397' ' ' ASP . 13.8 m -130.42 17.37 2.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 108.841 -0.799 . . . . 0.0 108.841 178.148 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 397' ' ' ASP . . . . . 0.449 ' CB ' ' O ' ' B' ' 396' ' ' VAL . 0.5 OUTLIER 159.47 58.73 0.0 OUTLIER Pre-proline 0 N--CA 1.451 -0.387 0 CA-C-N 114.578 -1.192 . . . . 0.0 109.184 -179.322 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.508 ' HB3' " C4'" ' A' ' 5' ' ' ' U' . 0.9 OUTLIER -42.93 -52.02 5.01 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 123.65 2.9 . . . . 0.0 112.285 -179.769 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.533 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 13.6 p30 -24.54 134.08 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.827 -179.431 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 38.9 t -138.81 151.05 46.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.984 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 1.097 HG23 HG23 ' B' ' 390' ' ' VAL . 0.3 OUTLIER -109.72 142.94 20.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.037 -179.946 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.863 HG21 ' O ' ' B' ' 423' ' ' ALA . 1.6 t -108.26 160.83 7.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.6 -179.097 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 0.791 ' CB ' HG23 ' B' ' 388' ' ' VAL . 2.4 mt-10 -131.37 116.28 17.35 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.725 179.166 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.584 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -102.11 107.05 18.01 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.358 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.547 ' HA ' ' O ' ' B' ' 410' ' ' THR . 22.9 ptt180 -144.2 165.21 28.5 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.671 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.778 HG12 ' HG ' ' B' ' 385' ' ' LEU . 1.3 m -147.47 160.34 8.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.102 -179.036 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 65.84 2.71 13.09 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.905 -0.664 . . . . 0.0 113.414 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 7.3 t0 72.32 13.79 5.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.928 0.364 . . . . 0.0 111.16 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -157.43 14.63 0.3 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.243 -0.98 . . . . 0.0 113.488 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.547 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 2.5 m -133.83 121.4 21.74 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 117.057 0.429 . . . . 0.0 111.478 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 19.1 t -106.47 102.83 14.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.61 0.243 . . . . 0.0 110.41 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.774 ' N ' HD13 ' B' ' 412' ' ' LEU . 0.0 OUTLIER -61.24 -25.33 67.0 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.838 -0.431 . . . . 0.0 109.838 179.422 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 413' ' ' GLY . . . . . 0.418 ' C ' ' SG ' ' B' ' 404' ' ' CYS . . . 164.61 -163.7 36.39 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.401 -0.904 . . . . 0.0 112.56 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.441 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 3.5 t -160.34 159.75 31.58 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.982 0.42 . . . . 0.0 111.4 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.522 ' CA ' ' HD2' ' B' ' 426' ' ' ARG . . . -152.01 165.0 30.61 Favored Glycine 0 C--O 1.225 -0.443 0 C-N-CA 120.173 -1.013 . . . . 0.0 114.111 -179.144 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 416' ' ' VAL . . . . . 0.685 HG23 ' HB ' ' B' ' 401' ' ' ILE . 0.8 OUTLIER -152.76 144.91 15.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.396 -0.402 . . . . 0.0 111.412 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 1.021 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -155.98 177.16 33.2 Favored Glycine 0 C--N 1.329 0.187 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.133 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.467 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 9.2 ptm180 -88.23 -43.26 11.72 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.848 0.324 . . . . 0.0 111.72 -179.7 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.71 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.2 OUTLIER -99.25 34.18 2.23 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 179.719 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.744 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 48.85 -45.04 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 178.509 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.653 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.7 OUTLIER -42.72 -56.04 3.34 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 -179.817 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 1.021 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -47.66 -24.94 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 CA-C-O 121.476 0.655 . . . . 0.0 109.513 178.32 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.863 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -76.48 -49.57 16.22 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.838 -1.074 . . . . 0.0 108.108 176.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 424' ' ' GLY . . . . . 0.489 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -63.92 -52.57 44.02 Favored Glycine 0 N--CA 1.448 -0.519 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.247 179.618 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.8 HG23 ' HA ' ' B' ' 367' ' ' ASP . 1.5 mm -64.65 -69.27 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.742 0.306 . . . . 0.0 110.531 179.155 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.544 ' HB3' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -47.37 -25.53 1.04 Allowed 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.278 -178.9 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.737 ' HB2' ' O ' ' B' ' 423' ' ' ALA . . . -60.7 -59.09 5.93 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 107.675 -1.232 . . . . 0.0 107.675 176.736 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 0.859 ' O ' HD13 ' B' ' 432' ' ' LEU . . . -52.92 -48.73 67.03 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 177.23 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.66 ' HA ' HD21 ' B' ' 432' ' ' LEU . 1.9 tt0 -52.94 -17.84 1.64 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.732 178.757 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 10.4 m120 -85.25 -35.78 21.35 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.047 178.681 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.509 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -67.32 -36.31 81.2 Favored 'General case' 0 N--CA 1.461 0.116 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.733 -179.271 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.878 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -94.01 12.2 27.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.805 179.58 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -87.04 -12.61 46.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.25 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 434' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -112.47 93.55 4.49 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.881 0.372 . . . . 0.0 111.4 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.556 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 8.9 ptmm? -57.37 -50.78 71.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.38 179.516 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.556 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -51.73 -45.39 63.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.637 179.896 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.608 ' SD ' HD12 ' B' ' 412' ' ' LEU . 1.2 ttp -72.81 -46.69 51.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.113 0.482 . . . . 0.0 110.238 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.878 HD11 ' HA ' ' B' ' 432' ' ' LEU . 62.1 mt -53.98 -60.44 3.33 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.672 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 439' ' ' ASP . . . . . 0.415 ' O ' ' N ' ' B' ' 442' ' ' ALA . 22.4 t70 -54.43 -44.3 72.32 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.515 179.19 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.493 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -43.49 -45.07 6.29 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.609 -0.885 . . . . 0.0 108.609 179.424 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.423 ' O ' ' C ' ' B' ' 442' ' ' ALA . 51.7 m-85 -64.65 -43.17 94.5 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.331 179.039 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 442' ' ' ALA . . . . . 0.456 ' O ' ' N ' ' B' ' 445' ' ' ARG . . . -42.32 -61.79 1.11 Allowed 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 178.415 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -48.86 -45.7 41.26 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.621 ' O ' HG23 ' B' ' 448' ' ' ILE . 1.2 mt-30 -65.19 -7.72 14.07 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.942 178.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.549 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -89.54 -44.18 10.29 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.374 179.441 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -82.37 -33.03 28.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.571 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 447' ' ' ALA . . . . . 0.428 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -60.71 -57.89 10.78 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.921 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.621 HG23 ' O ' ' B' ' 444' ' ' GLN . 12.7 pt -35.04 107.87 0.33 Allowed Pre-proline 0 N--CA 1.45 -0.454 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.899 179.491 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -82.84 126.08 4.4 Favored 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 123.046 2.498 . . . . 0.0 112.551 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.51 47.57 1.19 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.058 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 42.37 65.19 0.95 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.073 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -77.74 -65.41 0.97 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.671 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 453' ' ' SER . . . . . 0.415 ' OXT' ' OG ' ' B' ' 453' ' ' SER . 11.9 t . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.831 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.581 " O2'" " O5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.573 0 O4'-C1'-N19 111.388 3.188 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.717 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.136 0 O4'-C1'-N19 111.14 2.94 . 0.113 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.717 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.166 0 O4'-C1'-N19 111.077 2.877 . 0.448 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.62 " O2'" " C5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.247 0 C5'-C4'-C3' 111.325 -2.784 . 0.122 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.62 " C5'" " O2'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.041 0 O4'-C1'-N19 111.232 3.032 . 0.19 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.538 " O2'" " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.445 0 C3'-C2'-C1' 104.144 2.938 . 0.073 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.557 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.099 0 O4'-C1'-N19 111.429 3.229 . 0.138 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.63 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.236 0 C5'-C4'-C3' 111.57 -2.62 . 0.154 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.638 " O2'" " C5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.449 0 C5'-C4'-C3' 111.175 -2.884 . 0.124 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.638 " C5'" " O2'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -1.968 0 O4'-C1'-N19 111.185 2.985 . 0.021 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.621 " C5'" " O2'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.526 0 C5'-C4'-C3' 111.233 -2.845 . 0.044 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.748 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.034 0 O4'-C1'-N19 111.437 3.237 . 0.023 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.819 " O2'" " H5'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.149 0 O4'-C1'-N19 111.318 3.118 . 0.046 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.819 " H5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.545 0 C5'-C4'-C3' 111.203 -2.864 . 0.022 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.946 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.485 0 C5'-C4'-C3' 110.923 -3.051 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.946 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.433 -1.653 0 O4'-C1'-N19 111.62 3.42 . 0.241 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.891 ' H8 ' " O5'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.052 0 C3'-C2'-C1' 104.66 3.511 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.785 ' OP1' " H4'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.836 0 C5'-C4'-C3' 111.394 -2.737 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.661 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 1.992 0 O4'-C1'-N19 111.306 3.106 . 0.022 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.606 " H5'" " O2'" ' A' ' 19' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.554 0 C3'-C2'-C1' 104.887 3.763 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.587 " O2'" " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.258 0 C5'-C4'-C3' 111.056 -2.963 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.856 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.612 1.933 0 O4'-C1'-N19 111.0 2.8 . 0.037 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.801 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.445 0 O4'-C1'-N19 111.63 3.43 . 0.016 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.663 " C5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.265 0 C5'-C4'-C3' 111.367 -2.755 . 0.071 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . 0.407 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.438 2.035 0 O4'-C1'-N19 111.334 3.134 . 0.432 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.503 " H2'" ' C6 ' ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.349 0 O4'-C1'-N19 111.2 3.0 . 0.083 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.572 ' H6 ' " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.105 0 O4'-C1'-N19 110.996 2.796 . 0.21 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.591 " O2'" " O5'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.144 0 O4'-C1'-N19 111.219 3.019 . 0.127 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.591 " O5'" " O2'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.443 2.408 0 O4'-C1'-N19 110.984 2.784 . 0.143 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 0.588 ' C4 ' ' C4 ' ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.25 0 O4'-C1'-N19 111.31 3.11 . 0.212 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 0.588 ' C4 ' ' C4 ' ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.543 0 O4'-C1'-N19 111.489 3.289 . 0.191 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . 0.558 " O4'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.576 0 C5'-C4'-C3' 111.323 -2.784 . 0.14 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.226 0 N-CA-C 112.603 -0.199 . . . . 0.0 112.603 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 365' ' ' SER . . . . . 0.515 ' O ' ' CG2' ' B' ' 425' ' ' ILE . 4.6 t 54.13 24.86 5.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.951 0.405 . . . . 0.0 110.891 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 366' ' ' LEU . . . . . 0.684 HD23 ' OD1' ' B' ' 369' ' ' ASN . 14.9 tp -37.12 126.07 0.96 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.219 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.518 ' CG ' HD12 ' B' ' 425' ' ' ILE . 21.5 t0 -58.29 -64.92 0.75 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.179 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.498 ' HA ' ' CE ' ' B' ' 371' ' ' LYS . 1.5 ttp -35.82 -44.05 0.33 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.615 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 369' ' ' ASN . . . . . 0.684 ' OD1' HD23 ' B' ' 366' ' ' LEU . 3.0 m120 -60.99 -47.91 84.28 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.571 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 1.076 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -58.94 -70.59 0.14 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.626 179.503 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.498 ' CE ' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -36.22 -49.48 0.68 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.814 179.924 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.557 ' O ' ' CB ' ' B' ' 376' ' ' SER . 1.6 tmm_? -55.42 -38.44 68.98 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.508 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.547 ' O ' ' HB2' ' B' ' 377' ' ' LEU . 0.3 OUTLIER -65.58 -62.61 1.42 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.598 0.713 . . . . 0.0 110.425 179.175 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 0.67 HD13 ' OH ' ' B' ' 387' ' ' TYR . 1.0 OUTLIER -43.2 -70.77 0.1 Allowed 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -178.959 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -93.04 -20.83 20.16 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 -176.353 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.557 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.6 OUTLIER -94.45 1.6 55.76 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 119.91 -0.716 . . . . 0.0 111.1 -179.525 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.547 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 0.3 OUTLIER -134.68 -37.83 0.83 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.663 178.218 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.488 HG23 ' CB ' ' B' ' 441' ' ' TYR . 0.8 OUTLIER -127.76 -149.33 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.898 179.284 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.485 ' H ' HG22 ' B' ' 378' ' ' ILE . . . 28.74 74.24 0.03 OUTLIER Glycine 0 C--N 1.332 0.338 0 C-N-CA 121.35 -0.452 . . . . 0.0 113.506 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.68 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 13.7 p90 -100.12 -50.76 3.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.697 0.248 . . . . 0.0 111.176 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 381' ' ' ALA . . . . . 0.68 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 158.98 66.03 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.957 0.408 . . . . 0.0 111.079 179.753 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 382' ' ' SER . . . . . 0.57 ' HB2' ' CZ ' ' B' ' 380' ' ' TYR . 7.0 t -171.91 -72.18 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.795 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.465 HD21 ' HA2' ' B' ' 379' ' ' GLY . 2.6 pt? -49.22 -26.41 2.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.248 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 384' ' ' ARG . . . . . 0.475 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 7.1 tpt180 68.56 70.87 0.29 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.101 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.695 ' HG ' HG12 ' B' ' 406' ' ' VAL . 10.5 tt -89.18 121.98 32.02 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 179.118 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 386' ' ' HIS . . . . . 0.585 ' CE1' ' HG2' ' B' ' 405' ' ' ARG . 4.5 p80 -141.57 145.87 35.61 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.401 0.62 . . . . 0.0 112.584 -179.025 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.67 ' OH ' HD13 ' B' ' 374' ' ' LEU . 28.7 m-85 -99.43 151.85 20.64 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.363 178.156 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 388' ' ' VAL . . . . . 1.006 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -129.82 120.35 49.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.345 179.114 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.9 m -87.06 119.11 26.93 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.257 -179.06 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 0.998 HG23 HG23 ' B' ' 401' ' ' ILE . 34.0 m -126.75 151.94 34.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.132 179.382 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.582 ' CB ' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 73.81 111.72 0.07 Allowed 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -178.834 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.425 ' HA ' ' HD3' ' B' ' 393' ' ' PRO . 21.1 mttt -96.54 133.13 25.09 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 120.93 0.395 . . . . 0.0 111.281 -179.246 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.493 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 24.3 Cg_exo -62.22 166.04 13.64 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.631 2.22 . . . . 0.0 112.393 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 394' ' ' THR . . . . . 0.487 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 64.4 p -150.64 173.88 13.63 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.459 179.178 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -85.92 15.02 5.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.192 0.52 . . . . 0.0 110.58 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 22.8 m -146.79 16.73 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.272 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 167.86 68.29 0.01 OUTLIER Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.111 -179.391 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.532 ' HB2' ' O ' ' B' ' 418' ' ' ARG . 14.2 Cg_endo -55.4 -42.86 64.04 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 123.237 2.625 . . . . 0.0 112.311 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.548 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 6.0 m-20 -20.07 124.17 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.671 -179.064 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -133.79 141.57 47.53 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.361 178.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 0.998 HG23 HG23 ' B' ' 390' ' ' VAL . 0.2 OUTLIER -114.05 138.46 43.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-O 121.269 0.557 . . . . 0.0 111.376 -179.058 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.756 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.7 OUTLIER -105.11 166.7 3.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.433 -179.879 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 1.006 ' CB ' HG23 ' B' ' 388' ' ' VAL . 1.0 OUTLIER -133.8 112.59 11.46 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.045 0.45 . . . . 0.0 110.472 179.326 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.423 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -94.51 108.61 20.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.506 179.186 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.585 ' HG2' ' CE1' ' B' ' 386' ' ' HIS . 0.2 OUTLIER -150.3 169.28 21.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.151 0.501 . . . . 0.0 111.413 -179.439 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.695 HG12 ' HG ' ' B' ' 385' ' ' LEU . 1.2 m -144.59 145.21 21.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.775 -179.57 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 67.43 2.44 20.63 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.907 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 408' ' ' ASP . . . . . 0.499 ' HA ' ' HD3' ' B' ' 405' ' ' ARG . 16.5 t70 71.14 13.69 6.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.726 0.298 . . . . 0.0 111.066 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -137.11 -6.62 1.65 Allowed Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.395 -0.907 . . . . 0.0 113.6 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.562 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 95.3 m -127.03 119.71 27.28 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 117.15 0.475 . . . . 0.0 111.547 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 411' ' ' VAL . . . . . 0.514 ' HA ' ' HB2' ' B' ' 405' ' ' ARG . 41.5 t -102.89 97.09 5.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-O 120.752 0.31 . . . . 0.0 110.75 179.432 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.757 ' N ' HD13 ' B' ' 412' ' ' LEU . 0.0 OUTLIER -56.32 -22.48 30.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.696 -179.971 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 164.71 -165.66 37.6 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.405 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.683 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.0 OUTLIER -152.12 152.67 32.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.775 0.321 . . . . 0.0 110.732 -179.916 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.542 ' HA2' ' HG2' ' B' ' 426' ' ' ARG . . . -133.58 149.72 19.74 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 119.75 -1.214 . . . . 0.0 113.379 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 416' ' ' VAL . . . . . 0.566 HG13 ' O ' ' B' ' 416' ' ' VAL . 3.8 p -148.26 118.88 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.776 0.322 . . . . 0.0 110.544 179.293 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.654 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -133.29 164.66 24.22 Favored Glycine 0 C--O 1.226 -0.347 0 C-N-CA 120.842 -0.694 . . . . 0.0 111.395 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.532 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.5 OUTLIER -79.88 -48.1 14.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 117.465 0.632 . . . . 0.0 111.316 -179.953 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.909 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.2 OUTLIER -74.41 -23.62 58.98 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.758 -0.201 . . . . 0.0 111.096 -179.651 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.909 HG23 ' O ' ' B' ' 419' ' ' ASN . 0.9 OUTLIER 102.87 -43.61 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 C-N-CA 124.299 1.04 . . . . 0.0 109.946 -178.374 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.628 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -49.92 -54.59 18.76 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.032 -1.47 . . . . 0.0 107.032 178.605 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.706 HD11 ' H ' ' B' ' 419' ' ' ASN . 0.1 OUTLIER -53.21 -14.48 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.515 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.89 177.935 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.762 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -84.06 -49.14 9.19 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 107.22 -1.4 . . . . 0.0 107.22 176.487 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 424' ' ' GLY . . . . . 0.616 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -60.88 -54.17 39.15 Favored Glycine 0 C--N 1.336 0.534 0 N-CA-C 109.883 -1.287 . . . . 0.0 109.883 177.698 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.518 HD12 ' CG ' ' B' ' 367' ' ' ASP . 8.9 mm -53.96 -68.28 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 177.667 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.593 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 2.6 tpt180 -39.93 -28.56 0.05 Allowed 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.101 179.278 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.616 ' HB3' ' O ' ' B' ' 424' ' ' GLY . . . -64.68 -55.1 22.22 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 177.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 1.076 ' CB ' ' HB1' ' B' ' 370' ' ' ALA . . . -59.84 -55.01 39.47 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.477 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 429' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.07 -11.92 0.53 Allowed 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.794 179.285 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.502 ' ND2' ' O ' ' B' ' 426' ' ' ARG . 1.4 m-80 -92.09 -32.04 15.31 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 177.668 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.439 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -71.93 -44.9 62.88 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.027 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.856 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.4 OUTLIER -85.1 11.1 10.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.015 -179.948 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 433' ' ' ARG . . . . . 0.514 ' O ' ' HG2' ' B' ' 433' ' ' ARG . 0.0 OUTLIER -80.27 -0.1 35.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.372 179.816 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.469 ' O ' ' HG ' ' B' ' 438' ' ' LEU . 31.3 t0 -130.09 93.17 3.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.747 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.58 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -58.24 -39.7 79.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.867 -179.832 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.58 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 9.8 mtpt -57.27 -41.64 80.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.767 0.318 . . . . 0.0 110.414 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.648 ' SD ' HD12 ' B' ' 412' ' ' LEU . 33.7 ttp -74.67 -48.43 26.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.169 0.509 . . . . 0.0 109.811 179.059 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.856 HD11 ' HA ' ' B' ' 432' ' ' LEU . 94.1 mt -53.94 -64.42 0.83 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.192 178.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -51.95 -45.25 64.29 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.245 -0.888 . . . . 0.0 109.93 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.574 ' CE1' ' HG3' ' B' ' 444' ' ' GLN . 0.1 OUTLIER -45.2 -38.59 5.48 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 179.561 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.548 ' CE1' ' CE2' ' B' ' 440' ' ' PHE . 25.6 m-85 -74.44 -39.64 62.44 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.061 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -52.15 -60.52 3.11 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 178.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 8.7 tttp -50.7 -44.4 57.98 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.206 -0.665 . . . . 0.0 109.206 178.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.757 ' O ' HG23 ' B' ' 448' ' ' ILE . 0.5 OUTLIER -55.18 -50.75 68.57 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.028 178.787 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.615 ' HD2' ' CD1' ' B' ' 380' ' ' TYR . 7.8 mmp_? -51.69 -36.65 47.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.793 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -75.19 -41.14 58.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.956 0.408 . . . . 0.0 110.442 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 447' ' ' ALA . . . . . 0.458 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -65.99 -56.64 10.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.288 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.757 HG23 ' O ' ' B' ' 444' ' ' GLN . 1.1 pt -29.5 136.69 0.16 Allowed Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.723 179.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -48.1 167.44 0.1 Allowed 'Trans proline' 0 N--CA 1.464 -0.254 0 C-N-CA 122.995 2.463 . . . . 0.0 112.427 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 450' ' ' ARG . . . . . 0.411 ' O ' ' O ' ' B' ' 451' ' ' SER . 42.4 mtt-85 -105.67 87.11 2.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.946 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 451' ' ' SER . . . . . 0.411 ' O ' ' O ' ' B' ' 450' ' ' ARG . 1.7 m -49.38 -179.87 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.716 179.796 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -170.01 39.13 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.096 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.915 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.805 " O2'" ' H8 ' ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.777 0 O4'-C1'-N19 111.493 3.293 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.805 ' H8 ' " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.438 1.989 0 O4'-C1'-N19 111.215 3.015 . 0.2 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.684 HO2' " C5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.78 1 C3'-C2'-C1' 105.105 4.006 OUTLIER-DELTA 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.684 " C5'" HO2' ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.14 0 O4'-C1'-N19 111.303 3.103 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.762 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.115 0 O4'-C1'-N19 111.178 2.978 . 0.045 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.491 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.269 0 O4'-C1'-N19 111.04 2.84 . 0.143 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.676 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.039 0 O4'-C1'-N19 111.495 3.295 . 0.192 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.669 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.226 0 O4'-C1'-N19 110.988 2.788 . 0.322 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.669 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.403 0 C5'-C4'-C3' 111.364 -2.757 . 0.416 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.528 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 P--O5' 1.612 1.939 0 O4'-C1'-N19 111.198 2.998 . 0.081 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.632 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.165 0 O4'-C1'-N19 111.192 2.992 . 0.022 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.914 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 P--O5' 1.612 1.881 0 O4'-C1'-N19 111.066 2.866 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.914 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.599 0 C3'-C2'-C1' 104.565 3.405 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.748 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.597 0 C3'-C2'-C1' 104.273 3.081 . 0.181 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.748 " O4'" " H2'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.431 -1.812 0 C5'-C4'-C3' 111.036 -2.976 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.591 ' C8 ' ' C5 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.778 0 C5'-C4'-C3' 110.857 -3.095 . 0.384 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.607 " O2'" " C1'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.448 0 O4'-C1'-N19 111.194 2.994 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.641 ' N6 ' ' N3 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.432 -1.771 0 C5'-C4'-C3' 111.014 -2.991 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.546 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.238 0 O4'-C1'-N19 111.171 2.971 . 0.28 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.771 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.934 0 C5'-C4'-C3' 111.202 -2.865 . 0.131 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.771 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.395 0 O4'-C1'-N19 111.269 3.069 . 0.063 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.912 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.612 1.94 0 C5'-C4'-C3' 111.302 -2.799 . 0.015 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.785 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.254 0 O4'-C1'-N19 111.818 3.618 . 0.032 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.785 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 P--O5' 1.615 2.204 0 O4'-C1'-N19 110.863 2.663 . 0.125 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . 0.43 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.185 0 O4'-C1'-N19 111.238 3.038 . 0.165 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.56 HO2' " C5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.695 0 C5'-C4'-C3' 111.307 -2.795 . 0.098 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.835 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.138 0 C5'-C4'-C3' 111.353 -2.764 . 0.148 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.835 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.483 0 C3'-C2'-C1' 104.585 3.428 . 0.031 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.872 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.442 2.314 0 O4'-C1'-N19 111.202 3.002 . 0.191 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 0.877 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.279 0 O4'-C1'-N19 111.214 3.014 . 0.233 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 0.877 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.592 0 C3'-C2'-C1' 104.305 3.116 . 0.093 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . 0.493 " O4'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.556 0 C5'-C4'-C3' 111.271 -2.82 . 0.219 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 364' ' ' GLY . . . . . 0.504 ' O ' ' N ' ' B' ' 366' ' ' LEU . . . . . . . . 0 N--CA 1.49 2.255 0 N-CA-C 112.545 -0.222 . . . . 0.0 112.545 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 1.7 m -60.57 73.91 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.696 0.284 . . . . 0.0 110.902 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 366' ' ' LEU . . . . . 0.504 ' N ' ' O ' ' B' ' 364' ' ' GLY . 0.2 OUTLIER -129.81 120.54 25.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.886 0.374 . . . . 0.0 111.223 -179.698 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.523 ' CB ' HG13 ' B' ' 425' ' ' ILE . 0.0 OUTLIER -55.42 -71.08 0.09 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.601 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.434 ' HE3' ' HB3' ' B' ' 368' ' ' MET . 3.3 tmm? -35.72 -43.79 0.3 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.999 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 369' ' ' ASN . . . . . 0.463 ' HB2' ' HB3' ' B' ' 366' ' ' LEU . 87.1 m-20 -65.31 -42.9 92.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.896 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 0.806 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -62.76 -71.94 0.15 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.448 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.566 ' HG2' " O2'" ' A' ' 20' ' ' ' A' . 0.0 OUTLIER -35.82 -49.45 0.61 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.968 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.572 ' O ' ' CB ' ' B' ' 376' ' ' SER . 3.5 tmm_? -58.39 -37.03 74.45 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.924 0.393 . . . . 0.0 110.71 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.548 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -62.34 -48.61 79.05 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.219 0.533 . . . . 0.0 110.973 179.259 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 0.925 HD13 ' OH ' ' B' ' 387' ' ' TYR . 0.4 OUTLIER -62.42 -69.06 0.28 Allowed 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -178.127 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 375' ' ' TYR . . . . . 0.426 ' CG ' " H5'" ' A' ' 20' ' ' ' A' . 6.2 m-85 -70.83 -40.2 72.56 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -177.535 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.572 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.5 OUTLIER -71.9 -51.63 21.24 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.227 0.455 . . . . 0.0 112.227 -178.642 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.624 ' O ' HD13 ' B' ' 378' ' ' ILE . 2.3 mm? -89.32 -23.25 22.31 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 114.733 1.383 . . . . 0.0 114.733 -176.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.624 HD13 ' O ' ' B' ' 377' ' ' LEU . 20.8 mm -127.82 -74.77 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 119.219 0.918 . . . . 0.0 113.429 -178.018 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.562 ' N ' ' O ' ' B' ' 374' ' ' LEU . . . -51.61 80.43 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.176 0 CA-C-N 116.188 -0.46 . . . . 0.0 113.433 -178.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.95 ' OH ' HG21 ' B' ' 448' ' ' ILE . 14.5 p90 -102.05 173.18 6.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.757 0.313 . . . . 0.0 111.117 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 381' ' ' ALA . . . . . 0.442 ' C ' ' O ' ' B' ' 380' ' ' TYR . . . -28.07 -43.03 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.193 -179.281 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 382' ' ' SER . . . . . 0.637 ' O ' ' CE1' ' B' ' 380' ' ' TYR . 0.5 OUTLIER -114.39 132.34 56.26 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.839 -179.945 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.971 HD11 ' HB2' ' B' ' 385' ' ' LEU . 0.1 OUTLIER 151.31 -49.74 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.936 0.398 . . . . 0.0 110.479 -179.871 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 384' ' ' ARG . . . . . 0.743 ' N ' HD13 ' B' ' 383' ' ' LEU . 0.0 OUTLIER 69.88 73.75 0.23 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.064 178.708 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.971 ' HB2' HD11 ' B' ' 383' ' ' LEU . 6.0 tt -102.71 128.8 49.27 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 179.107 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 386' ' ' HIS . . . . . 0.478 ' O ' ' O ' ' B' ' 405' ' ' ARG . 14.9 p-80 -141.32 144.96 34.88 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.48 0.657 . . . . 0.0 112.761 -179.038 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.925 ' OH ' HD13 ' B' ' 374' ' ' LEU . 27.4 m-85 -103.06 145.93 29.15 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.748 178.633 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 388' ' ' VAL . . . . . 0.739 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -129.08 122.23 55.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.128 179.211 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.7 m -85.5 122.52 29.75 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.555 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 0.574 HG23 ' CG2' ' B' ' 401' ' ' ILE . 35.7 m -130.25 154.28 40.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.549 -179.808 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.555 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 9.0 tptt 95.07 23.01 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.326 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.532 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER 3.62 114.11 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.696 0 O-C-N 123.979 0.799 . . . . 0.0 112.192 179.931 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.47 ' HG3' ' HB2' ' B' ' 400' ' ' SER . 34.5 Cg_exo -55.2 163.64 4.41 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.525 2.15 . . . . 0.0 113.226 -179.17 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 394' ' ' THR . . . . . 0.473 ' CG2' ' OD1' ' B' ' 397' ' ' ASP . 0.1 OUTLIER -131.33 177.22 7.64 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.706 -1.133 . . . . 0.0 111.738 -179.288 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -102.08 18.0 21.87 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.565 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 396' ' ' VAL . . . . . 0.499 ' O ' ' HB3' ' B' ' 397' ' ' ASP . 10.1 m -137.4 6.57 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.984 178.262 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 397' ' ' ASP . . . . . 0.499 ' HB3' ' O ' ' B' ' 396' ' ' VAL . 17.8 p-10 172.79 54.17 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.384 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.464 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 93.1 Cg_exo -33.34 -29.18 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.613 2.875 . . . . 0.0 113.566 -179.161 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.559 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 1.1 p-10 -31.65 125.41 0.24 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.189 0.519 . . . . 0.0 111.854 -178.905 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 400' ' ' SER . . . . . 0.47 ' HB2' ' HG3' ' B' ' 393' ' ' PRO . 29.1 t -133.92 157.01 47.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.914 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 0.574 ' CG2' HG23 ' B' ' 390' ' ' VAL . 4.6 tt -114.85 151.58 16.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.14 0.495 . . . . 0.0 111.037 -179.723 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.681 ' O ' HG22 ' B' ' 414' ' ' THR . 0.4 OUTLIER -116.14 158.59 16.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.14 -178.971 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 0.739 ' CB ' HG23 ' B' ' 388' ' ' VAL . 3.6 mm-40 -122.79 118.37 27.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.884 179.012 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.666 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 8.9 t -96.77 100.04 11.6 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 179.056 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.651 ' HA ' ' O ' ' B' ' 410' ' ' THR . 13.1 ttp180 -140.35 162.73 34.59 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 121.033 0.444 . . . . 0.0 111.53 -179.036 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.654 HG12 ' HG ' ' B' ' 385' ' ' LEU . 2.0 m -146.5 -178.54 0.71 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.44 -179.328 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 58.86 -101.48 0.22 Allowed Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.914 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -156.95 18.37 0.31 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.874 0.368 . . . . 0.0 110.965 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 165.03 37.35 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.937 -0.649 . . . . 0.0 111.942 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.651 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 17.4 m -122.96 114.73 20.82 Favored 'General case' 0 C--O 1.217 -0.644 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 411' ' ' VAL . . . . . 0.485 HG22 ' HB2' ' B' ' 405' ' ' ARG . 47.1 t -107.33 107.79 23.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.581 0.229 . . . . 0.0 111.047 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.653 HD21 HG13 ' B' ' 406' ' ' VAL . 0.6 OUTLIER -66.91 -27.87 67.85 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 179.324 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 413' ' ' GLY . . . . . 0.53 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 167.26 -168.19 40.3 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.211 -0.995 . . . . 0.0 113.004 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.681 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.0 OUTLIER -145.58 155.97 43.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.697 0.284 . . . . 0.0 111.211 -179.364 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.545 ' O ' ' CG1' ' B' ' 401' ' ' ILE . . . -148.3 151.89 24.03 Favored Glycine 0 C--O 1.223 -0.564 0 C-N-CA 120.227 -0.987 . . . . 0.0 113.22 -179.477 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 416' ' ' VAL . . . . . 0.412 ' HB ' HG13 ' B' ' 401' ' ' ILE . 3.5 p -139.12 148.86 23.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.731 0.301 . . . . 0.0 110.978 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.825 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -160.53 152.59 23.35 Favored Glycine 0 C--O 1.228 -0.24 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.16 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.422 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 0.0 OUTLIER -68.81 -44.5 73.4 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.378 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.798 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.3 OUTLIER -98.05 32.08 2.52 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.185 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.724 HD12 ' C ' ' B' ' 420' ' ' ILE . 0.4 OUTLIER 51.55 -47.43 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 178.59 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.635 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -44.91 -54.79 6.09 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -179.577 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.825 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -50.39 -19.34 0.71 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.527 0 N-CA-C 109.9 -0.408 . . . . 0.0 109.9 178.486 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.663 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -83.23 -48.37 10.55 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 177.124 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 424' ' ' GLY . . . . . 0.711 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -59.78 -52.36 53.42 Favored Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 177.666 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.523 HG13 ' CB ' ' B' ' 367' ' ' ASP . 0.5 OUTLIER -57.61 -67.17 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 177.329 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.615 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 10.8 tpt180 -39.81 -30.19 0.08 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.096 178.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.711 ' HB3' ' O ' ' B' ' 424' ' ' GLY . . . -60.71 -61.42 2.6 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.139 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 0.806 ' CB ' ' HB1' ' B' ' 370' ' ' ALA . . . -53.23 -49.84 66.0 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 177.525 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.589 ' HA ' HD21 ' B' ' 432' ' ' LEU . 1.4 tt0 -47.51 -24.54 0.87 Allowed 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.431 178.639 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.53 ' HB3' ' HA3' ' B' ' 413' ' ' GLY . 14.2 m120 -81.71 -34.63 30.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.65 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.666 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -69.84 -42.28 73.79 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.718 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.966 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -83.66 9.62 11.2 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.889 -0.324 . . . . 0.0 111.408 -179.507 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 433' ' ' ARG . . . . . 0.453 ' HD2' ' HA ' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -88.68 -9.75 50.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.163 -179.587 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.5 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 76.7 m-20 -108.91 83.51 1.77 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.239 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.543 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 4.6 ptmm? -50.77 -53.38 32.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.027 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.543 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 10.0 mtpp -52.48 -43.98 65.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.736 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.5 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 14.3 tmm? -70.08 -50.52 40.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.964 0.412 . . . . 0.0 110.252 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.966 HD11 ' HA ' ' B' ' 432' ' ' LEU . 85.6 mt -52.77 -61.98 1.94 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.398 179.326 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -56.42 -44.13 80.08 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.032 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.45 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -42.29 -44.73 3.95 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.908 179.641 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.46 ' O ' ' HG2' ' B' ' 445' ' ' ARG . 49.9 m-85 -67.94 -44.49 76.71 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.62 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 442' ' ' ALA . . . . . 0.409 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -44.5 -60.54 1.92 Allowed 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 178.036 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 11.2 ttmt -47.76 -38.93 16.57 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.652 -0.703 . . . . 0.0 109.219 178.359 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.667 ' O ' HG23 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -61.3 -51.32 69.38 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 178.512 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.635 ' N ' ' HG3' ' B' ' 444' ' ' GLN . 0.3 OUTLIER -44.11 -43.95 7.26 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.993 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -80.59 -36.21 33.13 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.189 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 447' ' ' ALA . . . . . 0.46 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -63.31 -61.73 2.16 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.95 HG21 ' OH ' ' B' ' 380' ' ' TYR . 1.3 pt -28.16 139.74 0.09 OUTLIER Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.798 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 449' ' ' PRO . . . . . 0.436 ' O ' ' C ' ' B' ' 450' ' ' ARG . 96.5 Cg_endo -78.07 5.34 5.45 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.861 2.374 . . . . 0.0 112.359 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 450' ' ' ARG . . . . . 0.436 ' C ' ' O ' ' B' ' 449' ' ' PRO . 22.5 ptt180 33.1 49.59 0.19 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.303 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -166.27 160.12 15.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.027 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 452' ' ' GLU . . . . . 0.406 ' O ' ' CB ' ' B' ' 453' ' ' SER . 1.9 tm-20 -150.81 116.32 5.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.979 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 453' ' ' SER . . . . . 0.406 ' CB ' ' O ' ' B' ' 452' ' ' GLU . 1.6 m . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.981 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.576 ' H8 ' HO5' ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.437 1.906 0 C5'-C4'-C3' 110.976 -3.016 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.968 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.331 0 O4'-C1'-N19 111.26 3.06 . 0.234 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.968 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.17 0 O4'-C1'-N19 111.277 3.077 . 0.188 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.585 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.355 0 C5'-C4'-C3' 111.272 -2.819 . 0.053 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.695 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 P--O5' 1.613 1.976 0 O4'-C1'-N19 111.093 2.893 . 0.028 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.526 " O2'" " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.481 0 C5'-C4'-C3' 111.211 -2.859 . 0.088 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.699 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.928 0 O4'-C1'-N19 111.491 3.291 . 0.077 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.695 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.091 0 C5'-C4'-C3' 111.36 -2.76 . 0.087 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.695 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.579 0 C5'-C4'-C3' 111.073 -2.951 . 0.16 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.629 " C5'" " O2'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.342 0 C5'-C4'-C3' 110.97 -3.02 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.643 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.341 0 O4'-C1'-N19 111.369 3.169 . 0.033 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.987 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 P--O5' 1.614 2.06 0 O4'-C1'-N19 111.258 3.058 . 0.014 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.987 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.678 0 C3'-C2'-C1' 104.734 3.593 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.713 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.565 0 O4'-C1'-N19 111.592 3.392 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.713 " O4'" " H2'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.429 -1.983 0 C5'-C4'-C3' 111.087 -2.942 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.686 ' C8 ' ' C5 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.609 1.628 0 O4'-C1'-N19 111.386 3.186 . 0.128 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.715 " O2'" ' P ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.432 -1.753 0 O4'-C1'-N19 111.418 3.218 OUTLIER-EPSILON 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.719 " H2'" " O4'" ' A' ' 19' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.077 0 C5'-C4'-C3' 111.122 -2.918 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.719 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.142 0 O4'-C1'-N19 111.532 3.332 . 0.092 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.839 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.956 0 C5'-C4'-C3' 111.127 -2.915 . 0.178 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.839 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.515 0 C5'-C4'-C3' 111.085 -2.943 . 0.012 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.902 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.612 1.851 0 O4'-C1'-N19 111.244 3.044 . 0.017 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.672 " O2'" " C5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.167 0 O4'-C1'-N19 111.858 3.658 . 0.013 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.708 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.224 0 C5'-C4'-C3' 111.353 -2.765 . 0.059 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . 0.485 ' O6 ' ' O4 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.223 0 O4'-C1'-N19 111.324 3.124 . 0.616 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.497 " H2'" ' C6 ' ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.617 0 O4'-C1'-N19 111.087 2.887 . 0.083 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.784 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.012 0 C5'-C4'-C3' 111.234 -2.844 . 0.116 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.784 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.589 1 C3'-C2'-C1' 105.196 4.107 OUTLIER-DELTA 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.887 " H2'" " O4'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.043 0 O4'-C1'-N19 111.137 2.937 . 0.01 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 0.919 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.22 0 O4'-C1'-N19 111.556 3.356 . 0.131 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 0.919 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.726 0 C3'-C2'-C1' 104.643 3.492 . 0.045 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . 0.644 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.33 0 C5'-C4'-C3' 111.097 -2.935 . 0.268 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.248 0 N-CA-C 112.554 -0.218 . . . . 0.0 112.554 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 365' ' ' SER . . . . . 0.409 ' O ' ' OG ' ' B' ' 365' ' ' SER . 14.6 p -74.8 65.14 1.33 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.869 0.366 . . . . 0.0 110.894 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 366' ' ' LEU . . . . . 0.491 HD12 ' HA ' ' B' ' 366' ' ' LEU . 6.1 tp -114.08 13.43 18.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.369 0.604 . . . . 0.0 110.79 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.664 ' HB3' HD12 ' B' ' 425' ' ' ILE . 0.2 OUTLIER -44.75 -75.14 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.99 179.396 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.42 ' C ' ' O ' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -36.15 -44.2 0.38 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.666 179.779 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 369' ' ' ASN . . . . . 0.472 ' HB2' ' HG ' ' B' ' 366' ' ' LEU . 7.7 m120 -66.49 -38.36 87.11 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.921 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 0.927 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -61.31 -70.45 0.19 Allowed 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.831 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.556 ' HB3' " O2'" ' A' ' 20' ' ' ' A' . 0.0 OUTLIER -39.07 -42.17 0.88 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.061 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.559 ' O ' ' CB ' ' B' ' 376' ' ' SER . 3.0 tmt_? -53.49 -43.28 68.1 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.73 179.142 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.546 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.4 OUTLIER -64.43 -60.93 2.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.485 179.212 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 0.658 ' N ' HD23 ' B' ' 374' ' ' LEU . 0.7 OUTLIER -45.8 -74.4 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 -178.474 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 375' ' ' TYR . . . . . 0.426 ' HB2' " C5'" ' A' ' 20' ' ' ' A' . 3.8 m-30 -95.56 -4.7 44.21 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -176.459 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.559 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -108.84 1.15 20.7 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.044 -0.662 . . . . 0.0 110.337 179.017 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.723 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.2 OUTLIER -133.88 -40.16 0.86 Allowed 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 178.215 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.723 HD13 ' O ' ' B' ' 377' ' ' LEU . 2.1 mm -129.37 -144.88 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.609 179.353 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.479 ' H ' HG22 ' B' ' 378' ' ' ILE . . . 40.65 66.61 0.83 Allowed Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.993 -0.622 . . . . 0.0 113.701 179.026 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.676 ' O ' ' HB3' ' B' ' 381' ' ' ALA . 30.9 p90 -77.12 -4.03 42.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.802 0.301 . . . . 0.0 110.569 179.04 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 381' ' ' ALA . . . . . 0.676 ' HB3' ' O ' ' B' ' 380' ' ' TYR . . . 95.15 -38.53 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 178.736 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 382' ' ' SER . . . . . 0.443 ' HB3' ' CD2' ' B' ' 380' ' ' TYR . 11.1 t -86.59 24.9 1.33 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.172 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.646 HD12 ' CE1' ' B' ' 441' ' ' TYR . 0.4 OUTLIER -114.31 -5.8 12.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.699 0.285 . . . . 0.0 111.064 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 384' ' ' ARG . . . . . 0.501 ' O ' HG12 ' B' ' 406' ' ' VAL . 14.5 tpp180 63.68 59.14 1.2 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.994 0.426 . . . . 0.0 110.693 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.613 ' HA ' HG12 ' B' ' 406' ' ' VAL . 7.8 tt -114.43 133.11 55.97 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.907 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 386' ' ' HIS . . . . . 0.595 ' N ' HD23 ' B' ' 385' ' ' LEU . 15.5 p80 -158.85 160.73 36.51 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.631 0.729 . . . . 0.0 112.785 -179.078 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.615 ' CE2' ' HB1' ' B' ' 427' ' ' ALA . 8.0 m-85 -108.09 145.72 33.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.624 -1.171 . . . . 0.0 110.511 178.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 388' ' ' VAL . . . . . 0.461 HG23 ' HB2' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -127.86 125.56 65.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.536 179.108 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.6 m -86.14 123.87 31.91 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.499 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 1.009 HG23 HG23 ' B' ' 401' ' ' ILE . 19.6 m -129.89 156.97 42.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.01 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.84 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 86.49 19.9 0.08 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.036 179.868 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.509 ' C ' ' O ' ' B' ' 391' ' ' LYS . 1.3 mmmt -2.76 122.66 0.0 OUTLIER Pre-proline 0 N--CA 1.471 0.616 0 O-C-N 124.194 0.934 . . . . 0.0 112.551 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.526 ' HB2' " O2'" ' A' ' 5' ' ' ' U' . 12.4 Cg_exo -66.24 157.48 59.76 Favored 'Trans proline' 0 N--CA 1.464 -0.24 0 C-N-CA 122.695 2.263 . . . . 0.0 113.282 -179.577 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 394' ' ' THR . . . . . 0.463 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 0.3 OUTLIER -148.64 166.34 28.63 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.798 -1.092 . . . . 0.0 111.472 -179.764 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -82.69 10.13 8.16 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-O 121.089 0.471 . . . . 0.0 110.812 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 396' ' ' VAL . . . . . 0.563 HG12 " O2'" ' A' ' 30' ' ' ' C' . 27.2 m -132.67 15.04 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.386 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 165.73 57.46 0.0 OUTLIER Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 114.581 -1.19 . . . . 0.0 109.335 -179.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.512 ' HB3' " O4'" ' A' ' 5' ' ' ' U' . 1.0 OUTLIER -42.95 -54.64 3.24 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 123.483 2.789 . . . . 0.0 111.715 179.981 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.531 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 6.7 m120 -19.54 130.51 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.837 -1.074 . . . . 0.0 112.002 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -140.25 150.49 44.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.898 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 1.009 HG23 HG23 ' B' ' 390' ' ' VAL . 0.5 OUTLIER -115.44 143.98 24.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.985 -179.714 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.636 HG23 ' HB1' ' B' ' 423' ' ' ALA . 1.5 t -108.65 159.62 7.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.949 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 0.461 ' HB2' HG23 ' B' ' 388' ' ' VAL . 0.9 OUTLIER -134.03 123.35 24.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.442 179.568 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.533 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.1 OUTLIER -111.08 113.04 25.27 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 179.27 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.592 ' HA ' ' O ' ' B' ' 410' ' ' THR . 3.1 ptt180 -141.26 171.73 13.67 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 123.389 0.431 . . . . 0.0 111.675 -179.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.668 HG23 ' HB ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -139.32 166.7 21.18 Favored 'Isoleucine or valine' 0 C--O 1.239 0.536 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.383 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 407' ' ' GLY . . . . . 0.592 ' O ' ' CB ' ' B' ' 408' ' ' ASP . . . -45.26 103.3 0.05 OUTLIER Glycine 0 C--N 1.338 0.686 0 CA-C-N 114.879 -1.055 . . . . 0.0 113.335 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 408' ' ' ASP . . . . . 0.592 ' CB ' ' O ' ' B' ' 407' ' ' GLY . 3.8 t70 137.21 -9.14 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 123.796 0.838 . . . . 0.0 109.745 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 88.81 19.04 53.14 Favored Glycine 0 N--CA 1.442 -0.904 0 N-CA-C 110.876 -0.89 . . . . 0.0 110.876 -179.237 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.668 ' HB ' HG23 ' B' ' 406' ' ' VAL . 34.7 m -82.49 125.49 31.16 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 26.8 t -103.09 110.79 30.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 120.678 0.275 . . . . 0.0 110.301 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.843 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.3 OUTLIER -64.07 -28.91 70.11 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.286 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 167.58 -169.03 40.95 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.162 -1.018 . . . . 0.0 112.749 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.529 ' OG1' HD11 ' B' ' 401' ' ' ILE . 3.5 t -156.0 148.76 24.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.909 0.385 . . . . 0.0 110.949 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.539 ' HA2' ' HG2' ' B' ' 426' ' ' ARG . . . -131.6 162.42 23.75 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.261 -0.971 . . . . 0.0 113.279 -179.569 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 416' ' ' VAL . . . . . 0.413 ' HB ' HD12 ' B' ' 401' ' ' ILE . 3.5 p -142.57 150.4 18.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.689 -0.256 . . . . 0.0 110.731 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.89 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -172.57 150.0 12.18 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.165 -1.017 . . . . 0.0 113.008 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.418 ' HA ' ' CG ' ' B' ' 399' ' ' ASN . 0.0 OUTLIER -69.73 -43.28 72.64 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.822 0.344 . . . . 0.0 111.894 -179.701 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.728 ' H ' HD11 ' B' ' 422' ' ' ILE . 6.0 t30 -97.06 29.19 3.21 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.69 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 51.38 -45.43 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 178.401 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.647 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -43.95 -54.36 5.43 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 -179.92 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.89 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -48.07 -21.04 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.057 178.551 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.69 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -83.57 -47.71 11.02 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 177.35 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 424' ' ' GLY . . . . . 0.686 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -59.63 -52.23 54.28 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 110.136 -1.186 . . . . 0.0 110.136 177.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.664 HD12 ' HB3' ' B' ' 367' ' ' ASP . 4.8 mm -58.46 -67.15 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 177.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.579 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 24.2 tpt180 -38.01 -31.31 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.186 178.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.686 ' HB3' ' O ' ' B' ' 424' ' ' GLY . . . -62.93 -57.59 10.27 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 178.434 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 0.927 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -55.76 -52.39 64.12 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.67 178.695 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.48 ' OE2' ' HB2' ' B' ' 370' ' ' ALA . 0.7 OUTLIER -56.63 -18.25 11.43 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.706 179.369 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.512 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.9 OUTLIER -79.85 -40.8 27.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.407 178.862 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.487 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -67.46 -35.03 78.39 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.376 -179.317 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.7 ' HA ' HD21 ' B' ' 438' ' ' LEU . 0.2 OUTLIER -86.98 10.96 14.77 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.682 179.786 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -85.0 -9.07 58.42 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.079 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.544 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 62.7 m-20 -115.65 80.01 1.38 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.021 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.563 ' HA ' HD12 ' B' ' 438' ' ' LEU . 7.7 ptpt -48.92 -53.03 21.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.846 0.355 . . . . 0.0 110.278 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.55 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.2 OUTLIER -53.19 -42.42 66.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.551 179.809 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.843 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.8 OUTLIER -71.12 -45.77 62.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.24 0.543 . . . . 0.0 109.598 179.085 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.7 HD21 ' HA ' ' B' ' 432' ' ' LEU . 76.9 mt -52.64 -59.88 3.93 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.461 178.637 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -56.6 -44.26 80.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.007 -0.997 . . . . 0.0 109.718 178.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.524 ' CD1' ' C ' ' B' ' 440' ' ' PHE . 0.2 OUTLIER -43.38 -43.95 5.41 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.564 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.646 ' CE1' HD12 ' B' ' 383' ' ' LEU . 49.7 m-85 -66.37 -46.12 77.78 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.47 179.226 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 442' ' ' ALA . . . . . 0.441 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -42.27 -60.64 1.4 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 178.605 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -49.09 -47.43 45.16 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.189 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.528 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.1 OUTLIER -52.75 -58.78 5.75 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.485 179.157 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.558 ' HG2' ' CD1' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -42.73 -38.78 2.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.68 179.504 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -74.63 -36.8 62.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.637 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 447' ' ' ALA . . . . . 0.461 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -65.84 -63.15 1.15 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.446 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.496 HG13 ' O ' ' B' ' 445' ' ' ARG . 1.2 pp -29.39 119.02 0.29 Allowed Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.574 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 449' ' ' PRO . . . . . 0.498 ' O ' ' HB2' ' B' ' 450' ' ' ARG . 95.2 Cg_exo -44.98 -48.5 10.85 Favored 'Trans proline' 0 N--CA 1.464 -0.212 0 C-N-CA 122.862 2.374 . . . . 0.0 112.563 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 450' ' ' ARG . . . . . 0.498 ' HB2' ' O ' ' B' ' 449' ' ' PRO . 2.9 ttt-85 170.49 -67.59 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.014 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 77.9 p -118.93 -169.0 1.65 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.062 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -122.89 179.04 4.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.886 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.899 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.898 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.434 1.677 0 O4'-C1'-N19 111.335 3.135 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.898 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.443 2.407 0 O4'-C1'-N19 111.335 3.135 . 0.207 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.584 HO2' " C5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.436 0 O4'-C1'-N19 111.116 2.916 . 0.212 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.671 ' C6 ' ' C4 ' ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.038 0 O4'-C1'-N19 110.909 2.709 . 0.144 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.671 ' C4 ' ' C6 ' ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.078 0 O4'-C1'-N19 111.289 3.089 . 0.427 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.509 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.429 -2.026 0 O4'-C1'-N19 111.088 2.888 . 0.043 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.683 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.998 0 O4'-C1'-N19 111.25 3.05 . 0.112 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.59 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.217 0 O4'-C1'-N19 110.965 2.765 . 0.188 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.59 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.253 0 O4'-C1'-N19 111.152 2.952 . 0.075 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.735 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 P--O5' 1.611 1.792 0 C5'-C4'-C3' 110.994 -3.004 . 0.084 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.616 " C5'" " O2'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.366 0 C5'-C4'-C3' 111.263 -2.825 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.788 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.435 1.745 0 C5'-C4'-C3' 110.987 -3.009 . 0.073 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.788 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.547 0 C3'-C2'-C1' 104.739 3.599 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.646 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.331 0 O4'-C1'-N19 111.226 3.026 . 0.112 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.83 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.43 -1.919 0 C5'-C4'-C3' 110.945 -3.037 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.83 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.431 -1.801 0 O4'-C1'-N19 111.318 3.118 . 0.286 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.491 " H2'" ' C4 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.302 0 C5'-C4'-C3' 110.848 -3.102 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.661 ' N6 ' ' N3 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.656 0 C5'-C4'-C3' 110.869 -3.088 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.656 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.303 0 C5'-C4'-C3' 111.174 -2.884 . 0.263 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.565 " O4'" " O2'" ' A' ' 19' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.436 1.809 0 C5'-C4'-C3' 110.906 -3.062 . 0.238 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.833 HO2' ' H6 ' ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.49 0 C3'-C2'-C1' 104.293 3.103 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.878 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.042 0 O4'-C1'-N19 111.183 2.983 . 0.014 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.587 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.428 -2.109 0 O4'-C1'-N19 111.695 3.495 . 0.056 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.856 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.082 0 C5'-C4'-C3' 111.526 -2.649 . 0.076 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.44 2.173 0 O4'-C1'-N19 111.144 2.944 . 0.265 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.483 " H2'" ' C6 ' ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.189 0 O4'-C1'-N19 111.235 3.035 . 0.125 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.632 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 1.967 0 O4'-C1'-N19 111.053 2.853 . 0.416 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.632 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.432 0 C3'-C2'-C1' 104.271 3.079 . 0.058 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 1.028 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.247 0 O4'-C1'-N19 111.055 2.855 . 0.123 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 1.028 " H5'" " O2'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.249 0 O4'-C1'-N19 111.435 3.235 . 0.176 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 0.929 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.76 0 O4'-C1'-N19 111.243 3.043 . 0.1 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . 0.499 " C5'" HO2' ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.569 0 C5'-C4'-C3' 111.251 -2.833 . 0.134 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 364' ' ' GLY . . . . . 0.527 ' O ' ' CB ' ' B' ' 365' ' ' SER . . . . . . . . 0 N--CA 1.489 2.173 0 N-CA-C 112.536 -0.226 . . . . 0.0 112.536 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 365' ' ' SER . . . . . 0.527 ' CB ' ' O ' ' B' ' 364' ' ' GLY . 1.0 OUTLIER 86.27 27.42 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.868 0.366 . . . . 0.0 110.996 179.949 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 366' ' ' LEU . . . . . 0.552 HD12 ' OD1' ' B' ' 369' ' ' ASN . 2.2 tp -89.52 3.76 51.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.374 0.606 . . . . 0.0 111.26 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.827 ' HB3' HG23 ' B' ' 425' ' ' ILE . 0.0 OUTLIER -38.27 -72.7 0.06 Allowed 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.625 179.015 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.532 ' N ' ' HE2' ' B' ' 371' ' ' LYS . 0.3 OUTLIER -37.66 -36.88 0.19 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.052 179.813 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 369' ' ' ASN . . . . . 0.552 ' OD1' HD12 ' B' ' 366' ' ' LEU . 10.6 m120 -63.79 -43.29 96.79 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 0.799 ' HA ' HD13 ' B' ' 432' ' ' LEU . . . -60.55 -68.68 0.28 Allowed 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.532 ' HE2' ' N ' ' B' ' 368' ' ' MET . 0.1 OUTLIER -34.03 -49.39 0.35 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.711 -179.844 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.546 ' O ' ' CB ' ' B' ' 376' ' ' SER . 5.0 tmm_? -60.65 -36.59 79.05 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.922 179.833 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.637 ' NE2' ' HG ' ' B' ' 377' ' ' LEU . 1.6 tm0? -63.9 -49.81 71.21 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.88 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 0.624 ' N ' HD23 ' B' ' 374' ' ' LEU . 0.4 OUTLIER -58.51 -67.04 0.4 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.607 -178.843 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 375' ' ' TYR . . . . . 0.497 ' O ' ' HA3' ' B' ' 379' ' ' GLY . 3.3 m-85 -71.51 -50.79 27.97 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -177.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.546 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.5 OUTLIER -66.57 -53.97 28.73 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -178.789 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.637 ' HG ' ' NE2' ' B' ' 373' ' ' GLN . 0.1 OUTLIER -76.06 -38.27 57.3 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 -178.466 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.541 HD13 ' O ' ' B' ' 377' ' ' LEU . 4.8 mm -131.79 38.84 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.064 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.497 ' HA3' ' O ' ' B' ' 375' ' ' TYR . . . -121.99 63.15 0.52 Allowed Glycine 0 N--CA 1.453 -0.181 0 C-N-CA 120.372 -0.918 . . . . 0.0 112.552 179.579 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.636 ' O ' ' HB3' ' B' ' 381' ' ' ALA . 3.0 p90 -86.05 -3.23 58.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.527 0.204 . . . . 0.0 111.1 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 381' ' ' ALA . . . . . 0.636 ' HB3' ' O ' ' B' ' 380' ' ' TYR . . . 99.05 -171.05 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.592 -179.277 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 382' ' ' SER . . . . . 0.443 ' C ' ' O ' ' B' ' 381' ' ' ALA . 10.4 m 26.2 35.68 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.542 -0.754 . . . . 0.0 112.038 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.589 ' N ' ' O ' ' B' ' 381' ' ' ALA . 0.8 OUTLIER -103.21 -24.88 13.53 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.836 0.35 . . . . 0.0 110.914 -179.398 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 384' ' ' ARG . . . . . 0.497 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 3.5 tpt85 61.05 51.74 4.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.227 179.657 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.572 ' HA ' HG12 ' B' ' 406' ' ' VAL . 7.8 tt -94.87 123.99 38.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.067 179.229 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 386' ' ' HIS . . . . . 0.496 ' O ' ' O ' ' B' ' 405' ' ' ARG . 2.4 p80 -148.34 151.67 35.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.855 0.836 . . . . 0.0 113.179 -178.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.523 ' OH ' HD13 ' B' ' 374' ' ' LEU . 8.1 m-85 -105.45 156.66 17.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.724 -1.125 . . . . 0.0 110.11 178.389 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 388' ' ' VAL . . . . . 1.031 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -133.98 124.52 46.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.236 0.541 . . . . 0.0 110.847 179.588 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -85.21 119.93 26.14 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.439 -179.696 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 0.974 HG23 HG23 ' B' ' 401' ' ' ILE . 32.8 m -130.86 151.91 36.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.365 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.6 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.1 OUTLIER 85.2 16.02 0.16 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.335 179.638 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.53 ' C ' ' O ' ' B' ' 391' ' ' LYS . 22.3 mmtt -3.51 121.63 0.0 OUTLIER Pre-proline 0 N--CA 1.472 0.674 0 O-C-N 123.987 0.805 . . . . 0.0 112.348 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.482 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 25.5 Cg_exo -56.61 162.62 8.07 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.412 2.075 . . . . 0.0 112.788 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 394' ' ' THR . . . . . 0.495 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 1.1 p -156.5 168.57 26.95 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.399 -0.818 . . . . 0.0 111.73 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -81.24 8.03 9.93 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.103 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 396' ' ' VAL . . . . . 0.443 ' O ' ' HB2' ' B' ' 397' ' ' ASP . 24.2 m -132.11 14.83 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.448 0.642 . . . . 0.0 109.578 178.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 397' ' ' ASP . . . . . 0.443 ' HB2' ' O ' ' B' ' 396' ' ' VAL . 0.1 OUTLIER 166.03 58.33 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.765 -179.644 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.495 ' HA ' ' H ' ' B' ' 394' ' ' THR . 5.2 Cg_exo -39.86 -52.69 2.63 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 123.525 2.817 . . . . 0.0 112.281 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.54 ' HB3' ' HA ' ' B' ' 418' ' ' ARG . 19.2 p30 -25.11 132.14 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.323 -0.853 . . . . 0.0 112.113 -178.84 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 400' ' ' SER . . . . . 0.479 ' HB2' ' HG3' ' B' ' 393' ' ' PRO . 18.4 t -135.86 144.52 45.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.951 179.565 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 0.974 HG23 HG23 ' B' ' 390' ' ' VAL . 0.2 OUTLIER -112.27 139.46 36.85 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 CA-C-O 120.949 0.404 . . . . 0.0 110.662 -179.861 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.692 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.7 OUTLIER -100.01 161.23 3.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.773 -179.669 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 1.031 ' CB ' HG23 ' B' ' 388' ' ' VAL . 2.8 mm-40 -128.13 109.05 11.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.528 178.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.716 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 10.6 t -97.62 108.24 20.92 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.583 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.571 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -153.59 173.46 15.73 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.141 0.496 . . . . 0.0 111.532 -179.321 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.572 HG12 ' HA ' ' B' ' 385' ' ' LEU . 1.4 m -150.85 -175.84 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.989 -179.282 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 407' ' ' GLY . . . . . 0.418 ' N ' HG23 ' B' ' 406' ' ' VAL . . . 55.74 -103.85 0.27 Allowed Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.379 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -157.87 19.33 0.26 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.944 0.402 . . . . 0.0 110.883 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 173.05 25.52 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.878 -0.677 . . . . 0.0 113.145 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.571 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 24.4 m -113.17 110.3 20.19 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 117.102 0.451 . . . . 0.0 110.607 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 411' ' ' VAL . . . . . 0.456 ' HA ' ' HB3' ' B' ' 405' ' ' ARG . 10.5 t -102.33 95.48 3.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.678 0.275 . . . . 0.0 111.346 -179.712 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.624 ' N ' HD13 ' B' ' 412' ' ' LEU . 0.0 OUTLIER -56.28 -22.34 29.54 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.933 0.397 . . . . 0.0 110.009 179.466 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 164.68 -167.38 38.45 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.485 -0.864 . . . . 0.0 112.729 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.678 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.1 OUTLIER -153.53 148.14 26.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.887 0.375 . . . . 0.0 110.872 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.524 ' HA2' ' HG2' ' B' ' 426' ' ' ARG . . . -130.91 151.24 19.55 Favored Glycine 0 C--O 1.225 -0.449 0 C-N-CA 120.187 -1.006 . . . . 0.0 113.149 -179.462 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 416' ' ' VAL . . . . . 0.78 ' HB ' HD12 ' B' ' 401' ' ' ILE . 1.9 p -152.11 126.13 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.134 0.492 . . . . 0.0 111.554 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.932 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -138.24 170.1 23.98 Favored Glycine 0 N--CA 1.449 -0.464 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.834 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.54 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 0.6 OUTLIER -83.88 -47.42 11.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.977 0.388 . . . . 0.0 111.572 -179.69 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.936 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.2 OUTLIER -80.17 -25.77 39.63 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.53 -179.579 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.936 HG23 ' O ' ' B' ' 419' ' ' ASN . 1.5 pp 112.23 -43.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 124.703 1.201 . . . . 0.0 110.138 -179.138 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.559 ' N ' HD12 ' B' ' 420' ' ' ILE . 0.3 OUTLIER -45.8 -59.15 2.96 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 179.382 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.932 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -47.63 -16.75 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.473 0 CA-C-N 114.992 -1.003 . . . . 0.0 109.862 177.685 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.741 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -87.2 -49.89 6.98 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 177.66 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.12 -44.36 94.81 Favored Glycine 0 C--N 1.338 0.68 0 C-N-CA 119.776 -1.202 . . . . 0.0 110.503 178.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.827 HG23 ' HB3' ' B' ' 367' ' ' ASP . 1.1 mm -68.46 -65.03 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.277 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.616 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 12.9 tpt180 -40.17 -28.51 0.06 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.026 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.506 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -75.19 -52.96 9.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.714 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 0.713 ' HB1' ' CB ' ' B' ' 370' ' ' ALA . . . -50.32 -50.5 50.68 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.411 0.624 . . . . 0.0 109.439 178.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 1.005 ' HA ' HD22 ' B' ' 432' ' ' LEU . 57.8 mt-10 -60.19 -60.21 4.18 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 177.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.524 ' C ' ' O ' ' B' ' 429' ' ' GLU . 3.8 m120 -24.41 -45.73 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.308 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.716 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -70.63 -54.46 11.89 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-O 121.129 0.49 . . . . 0.0 110.103 178.873 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 1.005 HD22 ' HA ' ' B' ' 429' ' ' GLU . 0.0 OUTLIER -73.7 3.12 6.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.198 178.956 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 433' ' ' ARG . . . . . 0.573 ' N ' HD23 ' B' ' 432' ' ' LEU . 0.8 OUTLIER -87.21 -8.48 56.8 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.851 -179.104 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.483 ' O ' ' HG ' ' B' ' 438' ' ' LEU . 48.0 t0 -115.84 93.05 4.09 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.784 0.326 . . . . 0.0 110.905 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.609 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 0.6 OUTLIER -61.03 -42.2 98.02 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.178 -0.464 . . . . 0.0 109.875 179.54 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.609 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 25.4 mttt -54.61 -48.28 72.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.387 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.492 ' CE ' ' HG ' ' B' ' 412' ' ' LEU . 13.1 tmm? -71.46 -50.14 34.55 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.285 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.985 HD11 ' HA ' ' B' ' 432' ' ' LEU . 74.9 mt -50.81 -60.87 2.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.43 0.633 . . . . 0.0 110.123 179.349 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 439' ' ' ASP . . . . . 0.412 ' O ' ' N ' ' B' ' 442' ' ' ALA . 11.3 t70 -59.09 -41.5 88.22 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.321 178.685 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.529 ' CD1' ' C ' ' B' ' 440' ' ' PHE . 0.0 OUTLIER -44.04 -46.56 8.5 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 179.49 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.513 ' O ' ' CG ' ' B' ' 444' ' ' GLN . 55.9 m-85 -66.96 -39.78 87.32 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.22 179.042 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 442' ' ' ALA . . . . . 0.412 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -46.98 -60.16 2.63 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 177.704 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -47.32 -40.63 17.51 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.121 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.668 ' HG3' ' N ' ' B' ' 445' ' ' ARG . 0.0 OUTLIER -58.23 -52.15 66.78 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.678 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.668 ' N ' ' HG3' ' B' ' 444' ' ' GLN . 0.4 OUTLIER -45.74 -42.18 11.58 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.744 179.813 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -71.74 -38.29 70.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.09 0.472 . . . . 0.0 110.209 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 447' ' ' ALA . . . . . 0.51 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -73.95 -77.66 0.11 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.047 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.524 HD11 ' O ' ' B' ' 445' ' ' ARG . 0.5 OUTLIER 20.01 92.75 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.278 0 O-C-N 123.721 0.638 . . . . 0.0 111.897 -179.808 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_exo -41.65 161.82 0.03 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.924 2.416 . . . . 0.0 112.591 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.33 -4.42 45.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.854 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.72 120.14 32.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.678 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 51.3 102.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.027 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.972 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.588 " O2'" " O5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.513 0 O4'-C1'-N19 111.418 3.218 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.588 " O5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.112 0 O4'-C1'-N19 111.08 2.88 . 0.141 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.607 HO2' " C5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.766 0 C3'-C2'-C1' 104.97 3.855 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.607 " C5'" HO2' ' A' ' 3' ' ' ' G' . . . . . . . . 0 P--O5' 1.614 2.102 0 O4'-C1'-N19 111.07 2.87 . 0.048 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.529 ' C6 ' " H2'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.442 2.297 0 O4'-C1'-N19 111.383 3.183 . 0.141 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.636 HO2' " C5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.409 0 O4'-C1'-N19 111.285 3.085 . 0.193 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.636 " C5'" HO2' ' A' ' 6' ' ' ' A' . . . . . . . . 0 P--O5' 1.614 2.145 0 O4'-C1'-N19 111.249 3.049 . 0.078 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.656 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.207 0 O4'-C1'-N19 111.0 2.8 . 0.147 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.753 " O2'" " H5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.379 0 O4'-C1'-N19 110.983 2.783 . 0.166 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.753 " H5'" " O2'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.697 0 C3'-C2'-C1' 104.652 3.502 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.637 ' C2 ' ' C2 ' ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.64 0 C5'-C4'-C3' 111.089 -2.941 . 0.011 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.833 ' H6 ' " O5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 P--O5' 1.611 1.791 0 C5'-C4'-C3' 110.913 -3.058 . 0.014 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.751 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.651 0 C3'-C2'-C1' 104.817 3.685 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.741 ' C5 ' ' C8 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.447 0 O4'-C1'-N19 110.875 2.675 . 0.029 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.741 ' C8 ' ' C5 ' ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.455 0 C5'-C4'-C3' 111.014 -2.991 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.598 ' OP2' ' N2 ' ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.432 -1.764 0 O4'-C1'-N19 111.417 3.217 . 0.024 1t . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.451 ' P ' HO2' ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.485 0 C3'-C2'-C1' 104.584 3.426 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.67 ' N1 ' " O2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.804 0 C5'-C4'-C3' 110.806 -3.129 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.665 ' C2 ' ' NH2' ' B' ' 372' ' ' ARG . . . . . . . . 0 O4'--C4' 1.427 -2.132 0 O4'-C1'-N19 111.492 3.292 . 0.308 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.955 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.435 1.737 0 C5'-C4'-C3' 111.006 -2.996 . 0.083 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.955 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.556 0 C3'-C2'-C1' 104.557 3.397 . 0.051 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.775 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.025 0 O4'-C1'-N19 111.109 2.909 . 0.158 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.797 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.29 0 O4'-C1'-N19 111.318 3.118 . 0.074 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.797 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.681 0 C3'-C2'-C1' 105.01 3.9 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . 0.631 ' N7 ' ' C2 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.339 0 O4'-C1'-N19 111.206 3.006 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.578 HO2' " C5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.448 0 O4'-C1'-N19 111.214 3.014 . 0.214 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.752 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.075 0 O4'-C1'-N19 110.976 2.776 . 0.158 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.752 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.37 0 C3'-C2'-C1' 104.874 3.749 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.903 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.442 2.296 0 O4'-C1'-N19 111.116 2.916 . 0.052 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 0.903 " H5'" " O2'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.332 0 O4'-C1'-N19 111.61 3.41 . 0.266 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 0.76 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.549 0 O4'-C1'-N19 111.383 3.183 . 0.174 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . 0.568 " O4'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.294 0 O4'-C1'-N19 111.131 2.931 . 0.15 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 364' ' ' GLY . . . . . 0.459 ' O ' ' HB2' ' B' ' 365' ' ' SER . . . . . . . . 0 N--CA 1.488 2.162 0 N-CA-C 112.43 -0.268 . . . . 0.0 112.43 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 365' ' ' SER . . . . . 0.459 ' HB2' ' O ' ' B' ' 364' ' ' GLY . 0.1 OUTLIER 80.1 50.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.774 0.321 . . . . 0.0 110.989 179.787 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 366' ' ' LEU . . . . . . . . . . . . . 1.2 mp -128.09 124.04 36.02 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.056 0.455 . . . . 0.0 111.508 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.506 ' HB3' ' CG1' ' B' ' 425' ' ' ILE . 0.3 OUTLIER -54.75 -71.23 0.08 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.213 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.447 ' C ' ' O ' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -32.39 -49.36 0.2 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.931 179.805 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 57.2 m-20 -62.14 -47.42 84.64 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.685 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 1.084 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -61.64 -71.14 0.16 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.656 0.265 . . . . 0.0 110.303 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.517 ' HG2' " O2'" ' A' ' 20' ' ' ' A' . 0.2 OUTLIER -33.09 -46.46 0.16 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.038 179.849 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.666 ' CZ ' ' C2 ' ' A' ' 18' ' ' ' A' . 0.0 OUTLIER -66.69 -38.31 86.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.648 -179.484 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.848 HE22 HD22 ' B' ' 438' ' ' LEU . 3.8 tm0? -61.63 -59.02 5.84 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.352 0.596 . . . . 0.0 110.639 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 0.658 HD11 ' HB3' ' B' ' 431' ' ' ALA . 2.3 mm? -58.18 -65.34 0.66 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.9 -1.046 . . . . 0.0 112.749 -178.766 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 375' ' ' TYR . . . . . 0.541 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 63.2 m-85 -73.64 -42.37 61.5 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -177.351 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.554 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -78.36 -52.9 7.9 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.503 -0.479 . . . . 0.0 111.671 -179.267 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.607 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.6 OUTLIER -76.32 -31.28 58.08 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -178.376 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.607 HD13 ' O ' ' B' ' 377' ' ' LEU . 4.3 mm -141.56 39.12 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.81 -179.02 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.541 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -115.34 94.24 0.65 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.351 -0.928 . . . . 0.0 113.338 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.773 ' CE1' HD12 ' B' ' 383' ' ' LEU . 0.4 OUTLIER -145.77 -178.11 5.94 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.278 -0.268 . . . . 0.0 110.278 179.448 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -91.76 75.92 5.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.9 0.381 . . . . 0.0 111.373 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 382' ' ' SER . . . . . 0.588 ' HB2' ' CE2' ' B' ' 380' ' ' TYR . 0.7 OUTLIER -170.31 -68.68 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.864 179.686 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.852 HD22 ' N ' ' B' ' 384' ' ' ARG . 0.0 OUTLIER -51.12 -41.4 60.03 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.183 -0.302 . . . . 0.0 110.183 179.612 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 384' ' ' ARG . . . . . 0.852 ' N ' HD22 ' B' ' 383' ' ' LEU . 2.1 tpt85 72.78 89.41 0.09 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 178.804 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.75 ' HA ' HG12 ' B' ' 406' ' ' VAL . 0.1 OUTLIER -63.89 147.08 52.77 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.647 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 386' ' ' HIS . . . . . 0.538 ' CB ' ' O ' ' B' ' 405' ' ' ARG . 0.1 OUTLIER -147.94 70.18 1.14 Allowed 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -178.943 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.583 ' CE2' ' HB1' ' B' ' 427' ' ' ALA . 4.0 m-85 -91.59 113.65 25.97 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.383 177.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 388' ' ' VAL . . . . . 0.465 HG23 ' HB3' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -109.28 133.11 55.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.735 0.302 . . . . 0.0 110.706 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 5.3 m -87.76 125.35 34.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.0 0.429 . . . . 0.0 110.536 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 0.926 HG23 HG23 ' B' ' 401' ' ' ILE . 27.1 m -131.38 159.68 42.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.582 -179.602 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.828 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 88.4 23.48 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.45 179.41 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.519 ' O ' ' O ' ' B' ' 391' ' ' LYS . 9.6 mmtt 1.78 118.28 0.0 OUTLIER Pre-proline 0 N--CA 1.472 0.673 0 O-C-N 124.249 0.968 . . . . 0.0 112.476 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.467 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 22.8 Cg_exo -61.01 162.59 18.78 Favored 'Trans proline' 0 N--CA 1.463 -0.272 0 C-N-CA 122.677 2.251 . . . . 0.0 113.153 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 394' ' ' THR . . . . . 0.439 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 2.9 p -127.82 170.46 12.76 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.768 -1.106 . . . . 0.0 111.194 -179.709 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 395' ' ' ALA . . . . . 0.478 ' O ' " O2'" ' A' ' 30' ' ' ' C' . . . -97.09 19.64 12.59 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.227 0.537 . . . . 0.0 110.905 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 31.5 m -137.5 8.24 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.946 178.265 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 397' ' ' ASP . . . . . 0.495 ' O ' ' N ' ' B' ' 399' ' ' ASN . 1.2 m-20 164.91 62.47 0.0 OUTLIER Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 114.82 -1.082 . . . . 0.0 108.929 -179.289 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.546 ' HB2' ' O ' ' B' ' 418' ' ' ARG . 47.2 Cg_exo -34.04 -25.78 0.03 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 123.882 3.055 . . . . 0.0 113.943 -179.079 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.535 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 23.0 m120 -16.19 122.04 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 179.645 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -143.61 151.72 40.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.014 0.435 . . . . 0.0 111.303 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 0.926 HG23 HG23 ' B' ' 390' ' ' VAL . 0.7 OUTLIER -116.8 144.95 23.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.188 -179.591 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.664 ' O ' HG22 ' B' ' 414' ' ' THR . 0.2 OUTLIER -110.25 150.22 12.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.294 -179.714 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 0.475 ' O ' ' HA ' ' B' ' 387' ' ' TYR . 0.1 OUTLIER -109.43 103.7 12.65 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-O 120.922 0.392 . . . . 0.0 109.965 178.967 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.47 ' SG ' ' O ' ' B' ' 413' ' ' GLY . 0.0 OUTLIER -81.4 91.2 6.25 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 179.296 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.563 ' CG ' ' O ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -133.97 152.27 51.79 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.202 -179.046 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.75 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.9 OUTLIER -126.41 -174.5 1.08 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.507 0 CA-C-O 120.852 0.358 . . . . 0.0 111.202 -179.735 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 57.33 -94.4 0.04 OUTLIER Glycine 0 C--N 1.335 0.495 0 C-N-CA 120.791 -0.719 . . . . 0.0 111.872 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -164.45 26.51 0.07 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.019 0.438 . . . . 0.0 109.843 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 168.35 -16.48 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.526 -0.845 . . . . 0.0 113.146 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.563 ' O ' ' CG ' ' B' ' 405' ' ' ARG . 56.5 m -70.17 133.6 47.26 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 179.137 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 411' ' ' VAL . . . . . 0.602 HG12 ' N ' ' B' ' 412' ' ' LEU . 39.2 t -85.04 -115.15 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 C-N-CA 120.22 -0.592 . . . . 0.0 112.012 -178.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.602 ' N ' HG12 ' B' ' 411' ' ' VAL . 0.0 OUTLIER 138.24 -45.85 0.01 OUTLIER 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 -178.357 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 413' ' ' GLY . . . . . 0.477 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 173.38 -176.45 46.04 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 114.97 -1.014 . . . . 0.0 112.564 179.442 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.664 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.2 OUTLIER -144.04 155.26 43.92 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.749 -0.226 . . . . 0.0 110.731 -179.719 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.486 ' CA ' ' HG3' ' B' ' 426' ' ' ARG . . . -146.18 140.96 9.19 Favored Glycine 0 C--O 1.226 -0.365 0 C-N-CA 120.063 -1.065 . . . . 0.0 112.853 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 416' ' ' VAL . . . . . 0.425 ' HB ' HD12 ' B' ' 401' ' ' ILE . 9.4 p -130.94 152.35 37.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.55 0.214 . . . . 0.0 110.474 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.863 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -164.45 155.29 26.6 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.589 -0.815 . . . . 0.0 112.48 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.546 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 1.5 ptm180 -64.2 -44.05 93.15 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.452 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.775 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.6 OUTLIER -102.4 31.58 3.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.584 0.23 . . . . 0.0 110.412 179.304 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.743 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 54.28 -45.39 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 N-CA-C 114.676 1.361 . . . . 0.0 114.676 178.752 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.785 ' HG2' HD13 ' B' ' 425' ' ' ILE . 0.0 OUTLIER -44.41 -57.24 3.66 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.863 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -47.87 -24.27 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.328 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.743 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -79.62 -48.46 13.71 Favored 'General case' 0 N--CA 1.439 -1.017 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 177.05 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 424' ' ' GLY . . . . . 0.66 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -59.17 -50.33 68.9 Favored Glycine 0 N--CA 1.449 -0.477 0 N-CA-C 110.165 -1.174 . . . . 0.0 110.165 178.116 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.785 HD13 ' HG2' ' B' ' 421' ' ' LYS . 1.2 mp -59.47 -66.82 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 177.457 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.58 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 10.4 tpt180 -38.07 -31.87 0.06 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.091 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.66 ' HB3' ' O ' ' B' ' 424' ' ' GLY . . . -62.92 -62.39 1.75 Allowed 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.509 178.625 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 1.084 ' CB ' ' HB1' ' B' ' 370' ' ' ALA . . . -53.49 -50.26 65.74 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.462 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.6 ' O ' HD22 ' B' ' 432' ' ' LEU . 0.6 OUTLIER -56.03 -18.87 10.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.76 179.235 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.516 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.8 OUTLIER -81.34 -38.72 26.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.57 -0.287 . . . . 0.0 110.808 179.644 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.658 ' HB3' HD11 ' B' ' 374' ' ' LEU . . . -72.91 -33.42 65.98 Favored 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -178.246 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.877 ' C ' HD23 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -81.76 8.84 9.07 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.887 0.375 . . . . 0.0 111.527 -179.443 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 433' ' ' ARG . . . . . 0.684 ' N ' HD23 ' B' ' 432' ' ' LEU . 1.3 mtm180 -85.6 -3.91 59.01 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.939 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 434' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -115.25 79.55 1.3 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.386 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.542 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -48.0 -54.27 13.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.719 0.295 . . . . 0.0 111.071 -179.799 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.542 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 13.7 mtpp -55.2 -40.9 71.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.84 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.472 ' O ' ' HB3' ' B' ' 440' ' ' PHE . 17.5 tmm? -69.48 -52.97 21.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.993 0.425 . . . . 0.0 110.139 179.282 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.848 HD22 HE22 ' B' ' 373' ' ' GLN . 74.3 mt -50.73 -61.9 1.92 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.544 0.688 . . . . 0.0 110.329 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -49.43 -48.16 47.57 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.922 -1.035 . . . . 0.0 109.543 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.515 ' CD1' ' C ' ' B' ' 440' ' ' PHE . 0.1 OUTLIER -43.75 -42.67 5.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.484 179.743 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.622 ' CE2' ' HB2' ' B' ' 383' ' ' LEU . 36.8 m-85 -69.88 -36.74 75.69 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.094 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -51.34 -60.73 2.8 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 178.248 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 443' ' ' LYS . . . . . 0.424 ' C ' ' CD ' ' B' ' 443' ' ' LYS . 0.0 OUTLIER -48.08 -43.21 30.42 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.064 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.542 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 1.0 OUTLIER -55.38 -55.83 27.07 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.262 178.954 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.596 ' HD2' ' CD2' ' B' ' 380' ' ' TYR . 0.2 OUTLIER -44.39 -36.98 3.1 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.347 179.582 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -81.43 -36.37 29.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.642 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 447' ' ' ALA . . . . . 0.481 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -64.68 -67.56 0.43 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.238 -179.663 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.508 HG12 ' O ' ' B' ' 445' ' ' ARG . 0.1 OUTLIER 28.34 89.01 0.08 OUTLIER Pre-proline 0 N--CA 1.464 0.245 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.135 179.556 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 449' ' ' PRO . . . . . 0.42 ' HD2' ' HA ' ' B' ' 448' ' ' ILE . 2.6 Cg_endo -49.82 -19.76 4.04 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 122.844 2.363 . . . . 0.0 112.592 -179.246 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.09 -66.81 0.46 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.519 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -122.07 -171.02 2.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.94 0.4 . . . . 0.0 111.562 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 45.69 33.04 1.34 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.111 -179.86 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 5.2 p . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.233 -0.889 . . . . 0.0 111.012 179.808 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.376 0 O4'-C1'-N19 111.3 3.1 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.442 2.371 0 O4'-C1'-N19 111.278 3.078 . 0.375 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.691 HO2' " C5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.692 0 C3'-C2'-C1' 105.078 3.976 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.691 " C5'" HO2' ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.133 0 O4'-C1'-N19 111.393 3.193 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.519 " O4'" ' HB3' ' B' ' 398' ' ' PRO . . . . . . . . 0 O4'--C1' 1.439 2.119 0 O4'-C1'-N19 111.104 2.904 . 0.062 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.515 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.345 0 O4'-C1'-N19 111.107 2.907 . 0.127 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.8 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.922 0 O4'-C1'-N19 111.159 2.959 . 0.278 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.666 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.185 0 O4'-C1'-N19 111.222 3.022 . 0.334 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.666 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.439 0 O4'-C1'-N19 111.169 2.969 . 0.094 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.79 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.437 1.897 0 C5'-C4'-C3' 110.968 -3.021 . 0.032 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.636 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.39 0 C3'-C2'-C1' 104.154 2.949 . 0.02 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.678 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 P--O5' 1.612 1.903 0 O4'-C1'-N19 111.127 2.927 . 0.012 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.678 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.698 0 C3'-C2'-C1' 104.653 3.503 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.643 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.719 0 C3'-C2'-C1' 104.368 3.187 . 0.015 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.661 " C2'" ' H61' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.431 -1.827 0 C5'-C4'-C3' 111.091 -2.939 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.659 ' C8 ' ' C6 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.431 -1.863 0 C5'-C4'-C3' 110.623 -3.251 OUTLIER-EPSILON 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.595 ' OP2' " H1'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 P--O5' 1.613 1.99 0 C5'-C4'-C3' 110.859 -3.094 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.688 " O3'" ' H8 ' ' A' ' 19' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.281 0 O4'-C1'-N19 111.475 3.275 OUTLIER-EPSILON 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.688 ' H8 ' " O3'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.537 0 P-O3'-C3' 123.445 3.121 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.679 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.677 0 C5'-C4'-C3' 111.078 -2.948 . 0.202 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.592 " O2'" " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.54 0 C3'-C2'-C1' 104.414 3.238 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.847 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.974 0 C5'-C4'-C3' 111.196 -2.87 . 0.026 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.664 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.438 0 O4'-C1'-N19 111.73 3.53 . 0.029 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.686 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 P--O5' 1.616 2.343 0 O4'-C1'-N19 110.784 2.584 . 0.087 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . 0.503 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.254 0 O4'-C1'-N19 111.159 2.959 . 0.38 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.575 " O2'" " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.481 0 O4'-C1'-N19 111.179 2.979 . 0.155 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.676 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.024 0 C5'-C4'-C3' 111.185 -2.876 . 0.082 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.676 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.411 0 C3'-C2'-C1' 104.324 3.138 . 0.046 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.594 " O5'" " O2'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.443 2.405 0 O4'-C1'-N19 111.27 3.07 . 0.163 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 0.98 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.259 0 O4'-C1'-N19 111.311 3.111 . 0.044 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 0.98 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.413 0 O4'-C1'-N19 111.306 3.106 . 0.14 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . 0.603 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.57 0 C5'-C4'-C3' 111.058 -2.961 . 0.084 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.183 0 N-CA-C 112.556 -0.218 . . . . 0.0 112.556 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.68 54.63 0.31 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.755 0.312 . . . . 0.0 110.945 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 366' ' ' LEU . . . . . 0.526 ' O ' ' HB2' ' B' ' 369' ' ' ASN . 3.7 tp -75.8 0.56 17.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.54 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.546 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.1 OUTLIER -36.7 -77.11 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.917 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.548 ' CE ' ' N ' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -36.05 -41.28 0.24 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.988 178.994 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 369' ' ' ASN . . . . . 0.548 ' N ' ' CE ' ' B' ' 368' ' ' MET . 0.6 OUTLIER -61.8 -44.44 96.85 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.409 179.181 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 0.756 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -56.89 -68.46 0.22 Allowed 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.632 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.5 ' CE ' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -34.56 -47.93 0.34 Allowed 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.029 0.442 . . . . 0.0 110.35 -179.919 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.591 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.0 OUTLIER -56.57 -39.78 74.07 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.008 179.654 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.924 ' OE1' HD23 ' B' ' 377' ' ' LEU . 0.8 OUTLIER -63.62 -60.29 3.51 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.581 0.705 . . . . 0.0 110.751 179.31 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 0.936 HD11 ' HB2' ' B' ' 428' ' ' ALA . 0.2 OUTLIER -49.19 -72.47 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.114 -0.948 . . . . 0.0 113.428 -178.424 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 375' ' ' TYR . . . . . 0.49 ' HB2' " C5'" ' A' ' 20' ' ' ' A' . 3.8 m-85 -89.01 -2.99 58.84 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -176.496 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.591 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -119.04 5.73 11.32 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 119.915 -0.714 . . . . 0.0 111.415 179.811 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.924 HD23 ' OE1' ' B' ' 373' ' ' GLN . 9.9 tp -144.11 -32.91 0.42 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.493 179.215 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.527 ' CG1' ' OE1' ' B' ' 373' ' ' GLN . 3.8 mm -134.58 37.15 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 120.836 0.35 . . . . 0.0 111.378 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 379' ' ' GLY . . . . . . . . . . . . . . . -120.75 93.02 0.52 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.623 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.616 ' CZ ' ' HG ' ' B' ' 383' ' ' LEU . 0.1 OUTLIER -126.93 -98.58 0.39 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.519 0.199 . . . . 0.0 110.985 179.633 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -155.58 -41.42 0.08 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.737 0.303 . . . . 0.0 111.426 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 382' ' ' SER . . . . . 0.431 ' OG ' HG22 ' B' ' 448' ' ' ILE . 0.2 OUTLIER -56.26 -51.1 69.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.912 0.387 . . . . 0.0 110.645 -180.0 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.871 HD22 ' O ' ' B' ' 383' ' ' LEU . 0.0 OUTLIER -92.13 37.43 0.98 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.873 179.843 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 384' ' ' ARG . . . . . 0.495 ' O ' ' CG ' ' B' ' 384' ' ' ARG . 2.0 ptm180 -26.21 97.7 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.921 -179.632 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.725 HD22 ' HE1' ' B' ' 387' ' ' TYR . 0.3 OUTLIER -59.89 163.04 4.88 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.955 179.374 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 386' ' ' HIS . . . . . 0.488 ' CB ' ' O ' ' B' ' 405' ' ' ARG . 0.0 OUTLIER -160.27 83.71 0.71 Allowed 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -179.188 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.725 ' HE1' HD22 ' B' ' 385' ' ' LEU . 60.4 m-85 -87.77 114.91 24.83 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 177.419 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 388' ' ' VAL . . . . . 0.49 HG23 ' HB3' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -123.9 115.48 45.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.494 -0.483 . . . . 0.0 112.302 -179.372 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 389' ' ' THR . . . . . 0.574 HG23 ' OG ' ' B' ' 400' ' ' SER . 3.9 m -70.37 128.86 37.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.543 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 0.75 HG23 HG23 ' B' ' 401' ' ' ILE . 19.9 m -132.71 159.89 42.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.6 -179.385 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.54 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 92.68 36.85 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.771 179.743 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.51 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER 0.94 117.82 0.0 OUTLIER Pre-proline 0 N--CA 1.472 0.634 0 O-C-N 124.038 0.836 . . . . 0.0 112.704 179.596 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.519 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 26.4 Cg_exo -60.37 163.76 14.3 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.669 2.246 . . . . 0.0 113.249 -179.688 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 394' ' ' THR . . . . . 0.452 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 18.2 p -135.43 172.42 13.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.055 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 395' ' ' ALA . . . . . 0.413 ' CB ' ' O2 ' ' A' ' 29' ' ' ' U' . . . -98.05 18.36 16.24 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 121.174 0.512 . . . . 0.0 110.472 179.642 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 11.4 m -125.47 -0.85 5.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.967 178.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 397' ' ' ASP . . . . . 0.528 ' O ' ' N ' ' B' ' 399' ' ' ASN . 11.6 m-20 170.61 54.47 0.01 OUTLIER Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 114.625 -1.17 . . . . 0.0 108.599 -179.464 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.519 ' HB3' " O4'" ' A' ' 5' ' ' ' U' . 76.8 Cg_exo -29.56 -32.36 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 124.089 3.193 . . . . 0.0 113.517 -178.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.55 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 6.5 p30 -25.45 142.06 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.863 -178.719 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 400' ' ' SER . . . . . 0.574 ' OG ' HG23 ' B' ' 389' ' ' THR . 1.0 OUTLIER -140.79 158.07 44.49 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.643 -179.222 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 1.082 HD12 HG23 ' B' ' 416' ' ' VAL . 0.2 OUTLIER -110.48 144.49 18.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.432 -0.803 . . . . 0.0 111.303 -179.399 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.884 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.3 OUTLIER -109.7 146.21 15.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.777 -179.202 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 0.49 ' HB3' HG23 ' B' ' 388' ' ' VAL . 6.0 tt0 -111.79 95.95 5.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.073 179.093 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.496 ' SG ' ' CZ ' ' B' ' 387' ' ' TYR . 4.6 t -75.89 87.1 2.86 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.347 -0.842 . . . . 0.0 108.873 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.574 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -133.17 152.83 51.93 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.109 -179.205 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.85 HG22 ' HB ' ' B' ' 410' ' ' THR . 0.9 OUTLIER -145.94 151.27 14.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.714 -179.103 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 67.79 -103.91 1.06 Allowed Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.736 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -149.68 2.76 0.54 Allowed 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -166.37 22.61 0.12 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 119.896 -1.145 . . . . 0.0 113.18 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.903 HG21 ' OH ' ' B' ' 441' ' ' TYR . 0.2 OUTLIER -116.31 97.61 6.13 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 117.116 0.458 . . . . 0.0 110.926 179.536 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 411' ' ' VAL . . . . . 0.776 HG12 ' O ' ' B' ' 411' ' ' VAL . 56.1 t -106.36 64.92 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.705 179.18 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.841 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.1 OUTLIER -30.66 -35.33 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 120.676 0.274 . . . . 0.0 110.907 -179.56 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 413' ' ' GLY . . . . . 0.544 ' N ' ' O ' ' B' ' 411' ' ' VAL . . . 165.97 -157.38 29.82 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 119.721 -1.228 . . . . 0.0 113.494 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.5 ' O ' ' ND2' ' B' ' 430' ' ' ASN . 1.1 t -153.89 174.05 15.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.27 -0.465 . . . . 0.0 111.803 -178.634 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.762 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -158.02 139.76 6.56 Favored Glycine 0 C--O 1.222 -0.641 0 C-N-CA 120.298 -0.953 . . . . 0.0 113.123 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 416' ' ' VAL . . . . . 1.082 HG23 HD12 ' B' ' 401' ' ' ILE . 41.5 t -126.13 149.92 31.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 179.118 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.96 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -163.0 162.16 34.46 Favored Glycine 0 C--O 1.225 -0.407 0 C-N-CA 120.126 -1.035 . . . . 0.0 112.465 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.487 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 1.6 ptt180 -76.95 -41.87 41.45 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.707 0.254 . . . . 0.0 111.684 -179.751 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.789 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.2 OUTLIER -101.65 27.59 6.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.034 0.445 . . . . 0.0 109.824 179.009 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.687 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 55.75 -44.76 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 178.485 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.678 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.2 OUTLIER -43.49 -58.92 2.37 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 179.565 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.96 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -45.82 -26.23 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.667 178.658 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.884 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -77.51 -47.66 19.0 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 177.224 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 424' ' ' GLY . . . . . 0.586 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -63.6 -55.67 23.84 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.732 178.779 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.538 ' CG1' ' HB3' ' B' ' 367' ' ' ASP . 0.9 OUTLIER -58.25 -71.71 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 178.621 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.555 ' HB3' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -44.16 -26.19 0.29 Allowed 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.699 -178.743 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.592 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -61.62 -54.48 42.37 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 176.809 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 0.936 ' HB2' HD11 ' B' ' 374' ' ' LEU . . . -53.47 -49.49 67.34 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 107.964 -1.125 . . . . 0.0 107.964 177.444 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.817 ' HA ' HD22 ' B' ' 432' ' ' LEU . 49.7 mt-10 -53.99 -21.97 9.38 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.365 178.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.592 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.7 OUTLIER -75.73 -37.28 59.54 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 178.341 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.462 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -68.49 -48.47 64.36 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.299 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.817 HD22 ' HA ' ' B' ' 429' ' ' GLU . 0.1 OUTLIER -76.91 1.31 17.99 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.117 0.484 . . . . 0.0 111.343 -179.953 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 433' ' ' ARG . . . . . 0.806 ' N ' HD23 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -71.82 -14.26 61.92 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.883 -179.92 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.523 ' HB2' ' HB3' ' B' ' 437' ' ' MET . 5.6 m-20 -120.76 86.64 2.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.927 -178.853 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.583 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 6.1 ptpp? -52.61 -52.62 54.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.983 0.421 . . . . 0.0 110.213 179.275 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.583 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 5.4 mtpp -50.63 -36.41 35.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.546 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.841 ' SD ' HD12 ' B' ' 412' ' ' LEU . 1.1 ttp -80.11 -44.76 19.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.724 179.008 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.804 HD11 ' HA ' ' B' ' 432' ' ' LEU . 87.2 mt -53.08 -63.01 1.28 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.669 0.747 . . . . 0.0 109.545 178.709 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 439' ' ' ASP . . . . . 0.405 ' O ' ' C ' ' B' ' 440' ' ' PHE . 9.1 t70 -55.57 -44.51 76.93 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.029 -0.987 . . . . 0.0 108.973 178.507 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.463 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.1 OUTLIER -41.6 -42.26 2.41 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.187 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.903 ' OH ' HG21 ' B' ' 410' ' ' THR . 46.3 m-85 -68.11 -46.45 70.87 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.232 -0.894 . . . . 0.0 110.675 179.348 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 442' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -42.82 -60.82 1.45 Allowed 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 178.701 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.67 -44.21 57.63 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.84 178.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.522 ' O ' HG12 ' B' ' 448' ' ' ILE . 1.2 mt-30 -55.11 -55.38 31.7 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.06 179.278 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.735 ' O ' HD11 ' B' ' 448' ' ' ILE . 0.1 OUTLIER -50.49 -41.56 53.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.559 -179.89 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -65.72 -46.09 80.25 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.092 0.472 . . . . 0.0 110.263 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 447' ' ' ALA . . . . . 0.479 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -74.2 -76.61 0.13 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.76 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.735 HD11 ' O ' ' B' ' 445' ' ' ARG . 0.5 OUTLIER 23.94 87.44 0.08 OUTLIER Pre-proline 0 N--CA 1.463 0.219 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.904 -179.144 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 449' ' ' PRO . . . . . 0.422 ' O ' ' O ' ' B' ' 448' ' ' ILE . 54.4 Cg_exo -53.2 -161.91 0.0 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.158 0 C-N-CA 122.789 2.326 . . . . 0.0 112.181 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.59 -71.13 0.08 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.777 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 24.4 p -177.35 52.03 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.591 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -118.74 122.96 43.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.792 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 3.4 p . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.333 -0.842 . . . . 0.0 111.047 -179.926 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.756 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.434 1.684 0 O4'-C1'-N19 111.11 2.91 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.756 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.371 0 O4'-C1'-N19 111.245 3.045 . 0.337 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.598 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.441 0 O4'-C1'-N19 111.131 2.931 . 0.243 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.552 " H2'" ' C6 ' ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.187 0 O4'-C1'-N19 111.449 3.249 . 0.135 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.859 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 P--O5' 1.613 1.998 0 C5'-C4'-C3' 111.149 -2.9 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.782 " O2'" " H5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.415 0 O4'-C1'-N19 111.03 2.83 . 0.075 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.782 " H5'" " O2'" ' A' ' 6' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.94 0 O4'-C1'-N19 111.493 3.293 . 0.247 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.486 ' C4 ' ' N7 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.443 2.454 0 O4'-C1'-N19 111.089 2.889 . 0.233 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.488 " H2'" ' C6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.504 0 C5'-C4'-C3' 111.175 -2.883 . 0.104 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.757 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.435 1.722 0 C5'-C4'-C3' 110.896 -3.069 . 0.053 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.66 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.434 0 O4'-C1'-N19 111.472 3.272 . 0.018 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.705 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.095 0 O4'-C1'-N19 111.254 3.054 . 0.032 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.705 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.412 0 C3'-C2'-C1' 104.609 3.455 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.648 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.402 0 C5'-C4'-C3' 111.018 -2.988 . 0.026 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.771 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.43 -1.897 0 C5'-C4'-C3' 110.879 -3.081 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.771 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.431 -1.874 0 O4'-C1'-N19 111.489 3.289 . 0.18 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.519 " O2'" ' P ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.561 0 C5'-C4'-C3' 110.962 -3.025 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.569 " O2'" ' HB2' ' B' ' 376' ' ' SER . . . . . . . . 0 P--O5' 1.61 1.715 0 O4'-C1'-N19 110.991 2.791 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.447 " H2'" ' C8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.037 0 C5'-C4'-C3' 111.193 -2.871 . 0.225 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.81 " H2'" " O4'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.436 1.822 0 C5'-C4'-C3' 111.105 -2.93 . 0.334 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.81 " O4'" " H2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.524 0 C3'-C2'-C1' 104.167 2.963 . 0.037 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.905 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.614 2.05 0 O4'-C1'-N19 110.933 2.733 . 0.049 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.679 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.217 0 O4'-C1'-N19 111.665 3.465 . 0.045 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.764 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.225 0 O4'-C1'-N19 110.85 2.65 . 0.086 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . 0.448 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.261 0 O4'-C1'-N19 111.138 2.938 . 0.351 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.719 HO2' " C5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.315 0 O4'-C1'-N19 111.301 3.101 . 0.077 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.931 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 P--O5' 1.613 1.999 0 C5'-C4'-C3' 111.35 -2.767 . 0.139 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.931 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.286 0 C3'-C2'-C1' 104.299 3.11 . 0.027 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.93 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.28 0 O4'-C1'-N19 111.217 3.017 . 0.175 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 0.93 " H5'" " O2'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.297 0 O4'-C1'-N19 111.643 3.443 . 0.067 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 0.874 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.386 0 O4'-C1'-N19 111.406 3.206 . 0.155 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . 0.668 " H5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.277 0 O4'-C1'-N19 111.105 2.905 . 0.392 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.178 0 N-CA-C 112.444 -0.263 . . . . 0.0 112.444 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 15.2 m -134.31 41.14 2.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.876 0.369 . . . . 0.0 110.815 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 366' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -45.23 119.98 2.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.208 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.497 ' OD1' ' N ' ' B' ' 367' ' ' ASP . 0.1 OUTLIER -58.16 -64.96 0.73 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.941 179.363 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.509 ' SD ' " O2'" ' A' ' 15' ' ' ' A' . 1.4 ttp -33.74 -48.21 0.27 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.912 179.75 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 32.2 m-20 -61.8 -45.48 93.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.811 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 0.78 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -59.69 -69.67 0.2 Allowed 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.471 ' HD2' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -32.92 -52.74 0.34 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.977 0.418 . . . . 0.0 110.699 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.5 ' HG2' ' N3 ' ' A' ' 18' ' ' ' A' . 0.0 OUTLIER -58.4 -37.44 75.31 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.074 -179.966 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.6 ' HA ' ' HB2' ' B' ' 377' ' ' LEU . 0.9 OUTLIER -64.09 -65.91 0.61 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.598 0.713 . . . . 0.0 110.904 179.558 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 0.828 HD12 HD11 ' B' ' 385' ' ' LEU . 4.3 mm? -48.14 -68.23 0.2 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.208 -0.906 . . . . 0.0 112.621 -179.217 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 375' ' ' TYR . . . . . 0.518 ' CE2' ' OP1' ' A' ' 20' ' ' ' A' . 0.2 OUTLIER -79.4 -42.66 25.01 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 -176.785 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.569 ' HB2' " O2'" ' A' ' 18' ' ' ' A' . 0.0 OUTLIER -91.54 10.46 27.83 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -177.619 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.6 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.3 OUTLIER -140.67 -38.18 0.44 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.66 0.266 . . . . 0.0 111.213 179.264 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.572 ' O ' HD13 ' B' ' 383' ' ' LEU . 5.7 mm -121.73 34.64 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 121.081 0.467 . . . . 0.0 110.966 179.805 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 379' ' ' GLY . . . . . . . . . . . . . . . -149.31 69.75 0.33 Allowed Glycine 0 N--CA 1.453 -0.232 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.908 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.6 ' CG ' ' HD3' ' B' ' 445' ' ' ARG . 2.2 p90 -61.98 -59.87 4.46 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 -179.035 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 381' ' ' ALA . . . . . 0.576 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 170.29 -29.64 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.875 0.369 . . . . 0.0 111.59 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 382' ' ' SER . . . . . 0.488 ' HG ' ' HE2' ' B' ' 380' ' ' TYR . 0.3 OUTLIER -110.39 40.9 1.86 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.321 179.6 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.581 HD21 ' HB ' ' B' ' 406' ' ' VAL . 6.7 tt -115.35 -40.51 3.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.827 -179.604 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 65.3 65.97 0.55 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.198 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.828 HD11 HD12 ' B' ' 374' ' ' LEU . 0.7 OUTLIER -48.65 155.84 0.52 Allowed 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.482 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 386' ' ' HIS . . . . . 0.505 ' HB3' ' HG2' ' B' ' 405' ' ' ARG . 0.9 OUTLIER -153.3 98.17 2.24 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -178.681 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.75 ' HB2' ' HA ' ' B' ' 404' ' ' CYS . 0.1 OUTLIER -139.72 151.54 45.94 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.929 176.553 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -144.51 163.65 13.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.749 -177.079 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 3.4 m -102.78 129.95 49.59 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.077 0.465 . . . . 0.0 110.898 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 0.629 HG23 HG23 ' B' ' 401' ' ' ILE . 5.4 m -134.92 162.42 38.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.01 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.56 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 98.92 28.55 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.206 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.526 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.1 OUTLIER 0.37 117.52 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.679 0 O-C-N 124.119 0.887 . . . . 0.0 112.247 179.851 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.496 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 18.7 Cg_exo -62.72 158.35 42.68 Favored 'Trans proline' 0 N--CA 1.463 -0.304 0 C-N-CA 122.477 2.118 . . . . 0.0 113.401 -179.229 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 394' ' ' THR . . . . . 0.491 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 15.9 p -137.96 167.53 21.57 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.5 -1.227 . . . . 0.0 111.096 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 395' ' ' ALA . . . . . 0.553 ' O ' " O2'" ' A' ' 30' ' ' ' C' . . . -92.29 17.19 10.12 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-O 121.262 0.553 . . . . 0.0 110.22 179.165 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 396' ' ' VAL . . . . . 0.407 ' O ' ' CG ' ' B' ' 397' ' ' ASP . 17.4 m -125.67 -6.52 5.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.166 -0.924 . . . . 0.0 109.944 177.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 397' ' ' ASP . . . . . 0.465 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 28.9 m-20 179.45 54.46 0.05 OUTLIER Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 114.623 -1.172 . . . . 0.0 108.749 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.496 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 57.6 Cg_exo -31.76 -38.38 0.07 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 123.746 2.964 . . . . 0.0 113.643 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.607 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -28.31 139.91 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.493 0.663 . . . . 0.0 112.652 -177.775 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 400' ' ' SER . . . . . 0.426 ' O ' ' HB2' ' B' ' 423' ' ' ALA . 12.0 t -141.09 148.79 40.7 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.964 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 0.629 HG23 HG23 ' B' ' 390' ' ' VAL . 12.1 tt -107.57 156.22 8.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 121.133 0.492 . . . . 0.0 111.875 -179.508 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.734 HG23 ' O ' ' B' ' 415' ' ' GLY . 0.2 OUTLIER -127.99 141.1 47.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.652 -179.381 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 0.573 ' O ' ' HB2' ' B' ' 387' ' ' TYR . 0.7 OUTLIER -100.76 94.1 5.9 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.027 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.75 ' HA ' ' HB2' ' B' ' 387' ' ' TYR . 1.1 p -82.26 99.08 9.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.861 0.839 . . . . 0.0 110.391 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.741 ' HB2' HG22 ' B' ' 411' ' ' VAL . 0.2 OUTLIER -132.48 164.63 26.15 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.704 -178.71 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.581 ' HB ' HD21 ' B' ' 383' ' ' LEU . 1.2 m -132.59 128.5 57.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.953 0.406 . . . . 0.0 111.96 -178.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 407' ' ' GLY . . . . . 0.478 ' O ' ' HB3' ' B' ' 408' ' ' ASP . . . 79.64 8.49 87.68 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.921 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 408' ' ' ASP . . . . . 0.481 ' C ' ' HD2' ' B' ' 405' ' ' ARG . 9.2 t70 66.88 11.68 8.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.87 0.367 . . . . 0.0 110.632 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -125.97 -37.29 0.51 Allowed Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.492 -0.861 . . . . 0.0 112.99 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.623 HG22 HD13 ' B' ' 412' ' ' LEU . 95.0 m -103.13 136.77 42.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.959 0.409 . . . . 0.0 112.035 -179.097 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 411' ' ' VAL . . . . . 0.741 HG22 ' HB2' ' B' ' 405' ' ' ARG . 79.1 t -120.15 80.25 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.726 179.382 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.751 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.1 OUTLIER -41.19 -38.66 1.14 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.889 179.75 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 413' ' ' GLY . . . . . 0.468 ' O ' ' SG ' ' B' ' 404' ' ' CYS . . . 172.34 -169.73 42.82 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.374 -0.917 . . . . 0.0 112.916 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.446 ' C ' ' OD1' ' B' ' 430' ' ' ASN . 2.2 t -145.21 138.09 26.25 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.754 0.312 . . . . 0.0 111.207 -178.81 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.734 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -117.87 133.43 10.45 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.239 -0.982 . . . . 0.0 113.761 -179.013 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 416' ' ' VAL . . . . . 0.492 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 11.7 p -117.38 153.96 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 178.555 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.938 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -161.98 157.64 29.46 Favored Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.18 -1.01 . . . . 0.0 111.67 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.541 ' HA ' ' CB ' ' B' ' 399' ' ' ASN . 1.9 ptm180 -73.67 -40.29 63.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.918 0.39 . . . . 0.0 111.608 -179.324 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.826 ' H ' HD11 ' B' ' 422' ' ' ILE . 8.2 t30 -100.91 27.17 6.2 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.65 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.697 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 54.91 -47.76 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 179.82 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.517 ' HE2' " O3'" ' A' ' 22' ' ' ' C' . 0.0 OUTLIER -43.62 -59.02 2.37 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.116 -0.633 . . . . 0.0 109.377 -179.714 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.938 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -44.39 -22.2 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.325 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.844 177.906 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -80.95 -49.79 10.54 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 177.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 424' ' ' GLY . . . . . 0.506 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -56.36 -48.65 74.02 Favored Glycine 0 C--N 1.337 0.631 0 C-N-CA 119.586 -1.292 . . . . 0.0 110.3 178.344 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.606 ' N ' HD12 ' B' ' 425' ' ' ILE . 1.2 mp -65.4 -64.75 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 177.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.616 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 14.8 tpt180 -39.08 -31.27 0.07 Allowed 'General case' 0 C--O 1.225 -0.196 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.607 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -65.25 -52.32 55.23 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 178.053 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 0.78 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -55.91 -51.83 66.23 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 177.516 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.692 ' HA ' HD22 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -57.93 -31.65 67.02 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.862 179.251 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.593 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 19.0 m120 -57.43 -41.21 80.01 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.562 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.619 ' HB3' HD21 ' B' ' 374' ' ' LEU . . . -69.03 -45.14 71.23 Favored 'General case' 0 CA--C 1.527 0.084 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.686 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.964 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -77.67 -9.84 59.19 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.841 0.353 . . . . 0.0 111.445 -179.382 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 433' ' ' ARG . . . . . 0.739 ' N ' HD23 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -80.08 16.82 1.12 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.672 -179.504 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.48 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 90.3 m-20 -140.27 79.85 1.73 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.656 0.265 . . . . 0.0 110.337 179.103 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.589 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -46.69 -58.5 3.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.801 -179.551 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.589 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 1.6 mmpp? -49.65 -37.14 27.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.89 0.376 . . . . 0.0 110.451 -179.45 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.751 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.5 OUTLIER -73.84 -51.46 16.21 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.498 179.284 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.964 HD11 ' HA ' ' B' ' 432' ' ' LEU . 90.0 mt -52.36 -61.7 2.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.283 0.563 . . . . 0.0 110.691 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 439' ' ' ASP . . . . . 0.475 ' O ' ' N ' ' B' ' 442' ' ' ALA . 3.5 t70 -48.69 -51.13 30.15 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 178.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.479 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -40.13 -42.65 1.49 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.063 179.83 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.55 ' HA ' ' HG2' ' B' ' 444' ' ' GLN . 49.8 m-85 -67.72 -42.02 82.59 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.781 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 442' ' ' ALA . . . . . 0.475 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -43.04 -59.31 2.07 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 177.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.2 -42.91 41.69 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 177.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.846 ' O ' HG23 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -73.39 3.59 5.78 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.906 179.017 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.6 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -99.23 -45.02 6.03 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.371 179.238 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -79.38 -34.8 41.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.728 179.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 447' ' ' ALA . . . . . 0.526 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -66.8 -66.79 0.51 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.792 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.846 HG23 ' O ' ' B' ' 444' ' ' GLN . 1.1 pt -8.03 81.99 0.03 OUTLIER Pre-proline 0 N--CA 1.465 0.317 0 O-C-N 123.934 0.771 . . . . 0.0 112.551 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 449' ' ' PRO . . . . . 0.439 ' O ' ' CB ' ' B' ' 450' ' ' ARG . 77.7 Cg_exo -37.77 -59.95 0.48 Allowed 'Trans proline' 0 N--CA 1.461 -0.44 0 C-N-CA 122.914 2.409 . . . . 0.0 112.453 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 450' ' ' ARG . . . . . 0.439 ' CB ' ' O ' ' B' ' 449' ' ' PRO . 0.0 OUTLIER 78.2 38.0 0.18 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.728 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 17.9 t 50.98 62.68 2.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.825 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -99.19 112.83 24.89 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.624 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.006 -179.796 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.788 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 C2'--O2' 1.433 1.507 0 C5'-C4'-C3' 111.03 -2.98 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.788 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.331 0 O4'-C1'-N19 111.251 3.051 . 0.133 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.537 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.278 0 O4'-C1'-N19 111.134 2.934 . 0.354 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.525 " H2'" ' C6 ' ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.133 0 O4'-C1'-N19 111.208 3.008 . 0.125 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.525 ' C6 ' " H2'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.291 0 O4'-C1'-N19 111.467 3.267 . 0.144 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.642 " O2'" " C5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.479 0 C3'-C2'-C1' 104.241 3.045 . 0.072 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.642 " C5'" " O2'" ' A' ' 6' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.124 0 O4'-C1'-N19 111.324 3.124 . 0.104 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.408 ' C4 ' ' N7 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.443 2.39 0 O4'-C1'-N19 111.144 2.944 . 0.366 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.466 " H2'" ' C6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.399 0 O4'-C1'-N19 111.148 2.948 . 0.099 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.643 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 1.965 0 O4'-C1'-N19 111.23 3.03 . 0.163 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.641 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.427 0 O4'-C1'-N19 111.275 3.075 . 0.046 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.816 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.436 1.858 0 C5'-C4'-C3' 110.994 -3.004 . 0.017 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.816 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.608 0 C3'-C2'-C1' 104.795 3.661 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.717 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.263 0 C5'-C4'-C3' 111.143 -2.905 . 0.048 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.907 " O2'" " H5'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.139 0 C5'-C4'-C3' 110.836 -3.109 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.907 " H5'" " O2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.612 1.894 0 O4'-C1'-N19 111.361 3.161 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.918 " H1'" ' OP1' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.433 -1.639 0 C5'-C4'-C3' 110.863 -3.091 OUTLIER-EPSILON 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.918 ' OP1' " H1'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.001 0 C5'-C4'-C3' 111.108 -2.928 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.753 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -1.97 0 O4'-C1'-N19 111.229 3.029 . 0.038 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.834 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.436 1.828 0 C5'-C4'-C3' 110.998 -3.002 . 0.142 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.834 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.436 0 C5'-C4'-C3' 111.067 -2.955 . 0.033 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.794 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.16 0 O4'-C1'-N19 111.176 2.976 . 0.128 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.571 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.295 0 O4'-C1'-N19 111.76 3.56 . 0.105 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.787 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 P--O5' 1.615 2.151 0 C5'-C4'-C3' 111.612 -2.592 . 0.096 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . 0.422 ' O6 ' ' O6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.187 0 O4'-C1'-N19 111.334 3.134 . 0.254 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.572 " O2'" " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.731 0 C5'-C4'-C3' 111.186 -2.876 . 0.081 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.929 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.19 0 O4'-C1'-N19 111.108 2.908 . 0.129 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.929 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.262 0 C3'-C2'-C1' 104.253 3.059 . 0.132 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.637 " C5'" " O2'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.274 0 O4'-C1'-N19 111.207 3.007 . 0.214 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 0.617 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.443 2.412 0 O4'-C1'-N19 111.351 3.151 . 0.111 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 0.803 " O2'" " H5'" ' A' ' 32' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.5 0 O4'-C1'-N19 111.224 3.024 . 0.636 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . 0.803 " H5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.595 0 C5'-C4'-C3' 111.148 -2.901 . 0.582 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.219 0 N-CA-C 112.638 -0.185 . . . . 0.0 112.638 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 6.9 m -71.26 86.53 0.8 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.814 0.34 . . . . 0.0 110.941 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 366' ' ' LEU . . . . . 0.466 HD23 ' HB3' ' B' ' 368' ' ' MET . 0.2 OUTLIER -125.31 119.89 29.64 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.081 -179.861 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.457 ' OD2' HG13 ' B' ' 425' ' ' ILE . 3.9 t70 -59.58 -61.56 2.53 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.809 179.329 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.524 ' O ' ' HB2' ' B' ' 372' ' ' ARG . 8.8 ttp -34.6 -50.47 0.45 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.611 179.477 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -61.92 -48.01 82.35 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.694 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 0.935 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -64.94 -72.5 0.15 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.743 0.306 . . . . 0.0 110.69 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.565 ' HE3' ' H21' ' A' ' 19' ' ' ' G' . 0.0 OUTLIER -34.86 -42.55 0.16 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.857 179.828 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.556 ' O ' ' CB ' ' B' ' 376' ' ' SER . 1.8 ttp-105 -66.64 -39.23 88.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.235 -179.792 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.781 HE22 ' HG ' ' B' ' 377' ' ' LEU . 1.4 tm0? -62.49 -54.67 36.63 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.209 0.528 . . . . 0.0 110.415 179.54 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 0.545 HD21 ' O ' ' B' ' 428' ' ' ALA . 1.1 mm? -55.93 -68.53 0.2 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.267 -0.878 . . . . 0.0 113.048 -179.102 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 375' ' ' TYR . . . . . 0.582 ' CE2' ' OP1' ' A' ' 20' ' ' ' A' . 3.5 m-85 -74.91 -45.13 44.72 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -177.557 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.556 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -70.8 -54.25 12.33 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.319 -0.552 . . . . 0.0 111.386 -179.404 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.781 ' HG ' HE22 ' B' ' 373' ' ' GLN . 0.0 OUTLIER -71.02 -43.59 67.61 Favored 'General case' 0 CA--C 1.509 -0.618 0 CA-C-O 121.196 0.522 . . . . 0.0 109.971 -178.856 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.627 HG23 ' HB3' ' B' ' 441' ' ' TYR . 2.4 mm -120.36 -138.5 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.926 0 CA-C-N 115.374 -0.83 . . . . 0.0 108.878 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.522 ' O ' ' O ' ' B' ' 380' ' ' TYR . . . 99.53 -22.37 40.91 Favored Glycine 0 C--N 1.321 -0.3 0 C-N-CA 120.943 -0.646 . . . . 0.0 112.089 -179.678 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 1.094 ' CB ' HD22 ' B' ' 383' ' ' LEU . 0.1 OUTLIER 34.92 -175.41 0.0 OUTLIER 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 178.867 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -121.16 -28.2 4.76 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 113.092 -1.867 . . . . 0.0 109.985 179.34 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -143.57 50.49 1.37 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.653 179.622 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 1.094 HD22 ' CB ' ' B' ' 380' ' ' TYR . 0.8 OUTLIER -116.4 -36.14 4.09 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 120.913 0.387 . . . . 0.0 110.421 178.857 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 384' ' ' ARG . . . . . 0.72 ' H ' HD23 ' B' ' 383' ' ' LEU . 1.9 tpt85 74.71 78.76 0.11 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.718 179.173 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.678 ' HG ' HG12 ' B' ' 406' ' ' VAL . 9.7 tt -107.25 124.29 49.54 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 178.837 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 386' ' ' HIS . . . . . 0.421 ' O ' ' O ' ' B' ' 405' ' ' ARG . 26.4 p-80 -145.22 145.91 31.5 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 -178.185 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.676 ' HE1' HD21 ' B' ' 385' ' ' LEU . 3.9 m-85 -106.05 147.74 28.55 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 114.56 -1.2 . . . . 0.0 111.066 178.319 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 388' ' ' VAL . . . . . 0.535 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -133.43 128.64 55.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.351 179.448 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.2 m -86.83 123.75 32.31 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.963 179.261 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 0.907 HG23 HG23 ' B' ' 401' ' ' ILE . 29.1 m -130.06 154.84 40.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.363 0.602 . . . . 0.0 112.222 -179.314 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.54 ' O ' ' C ' ' B' ' 392' ' ' LYS . 4.4 tptt 90.7 23.68 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.544 179.508 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.54 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.1 OUTLIER 1.71 108.37 0.01 OUTLIER Pre-proline 0 N--CA 1.468 0.439 0 O-C-N 123.966 0.792 . . . . 0.0 112.44 179.766 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.492 ' HD2' ' HA ' ' B' ' 392' ' ' LYS . 6.0 Cg_exo -45.55 160.41 0.16 Allowed 'Trans proline' 0 N--CA 1.462 -0.33 0 C-N-CA 122.856 2.37 . . . . 0.0 113.514 -179.174 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 31.8 p -127.2 169.76 13.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.53 179.286 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 395' ' ' ALA . . . . . 0.483 ' O ' " O2'" ' A' ' 30' ' ' ' C' . . . -96.19 20.21 10.65 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 121.24 0.543 . . . . 0.0 110.715 179.626 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 33.6 m -136.05 6.64 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.005 178.15 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 397' ' ' ASP . . . . . 0.455 ' O ' ' N ' ' B' ' 399' ' ' ASN . 0.2 OUTLIER 168.17 58.09 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 114.949 -1.023 . . . . 0.0 108.847 -179.38 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.477 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 3.3 Cg_exo -35.64 -27.3 0.05 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 124.062 3.175 . . . . 0.0 113.108 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.599 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 1.3 p-10 -29.28 120.43 0.14 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.619 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 400' ' ' SER . . . . . 0.428 ' OG ' ' HD3' ' B' ' 393' ' ' PRO . 48.9 m -130.71 158.17 40.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.906 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 0.907 HG23 HG23 ' B' ' 390' ' ' VAL . 0.4 OUTLIER -115.14 144.89 21.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.991 -179.796 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.677 HG21 ' C ' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -110.77 157.59 11.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.558 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 0.535 ' CB ' HG23 ' B' ' 388' ' ' VAL . 2.4 mm-40 -123.9 119.4 29.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.102 179.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.59 ' HB3' ' CZ ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -102.39 103.23 13.63 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.669 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.54 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.8 OUTLIER -142.68 170.44 15.7 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.125 -179.305 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.678 HG12 ' HG ' ' B' ' 385' ' ' LEU . 1.0 OUTLIER -148.57 177.69 0.88 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.547 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.515 -179.03 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 58.2 -102.84 0.28 Allowed Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 115.153 -0.93 . . . . 0.0 112.577 179.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -158.13 21.16 0.25 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.751 0.31 . . . . 0.0 110.842 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 170.99 31.95 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.667 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.54 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 99.3 m -124.31 111.68 16.1 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 121.05 -0.26 . . . . 0.0 110.983 179.519 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 58.2 t -103.61 107.43 22.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 178.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.564 ' HB3' ' HA ' ' B' ' 431' ' ' ALA . 0.0 OUTLIER -68.42 -26.11 65.37 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.633 -179.829 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 413' ' ' GLY . . . . . 0.464 ' O ' ' SG ' ' B' ' 404' ' ' CYS . . . 174.34 -177.22 46.61 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.874 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.443 ' O ' ' ND2' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -146.37 152.68 39.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.787 -0.206 . . . . 0.0 110.79 -179.832 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.437 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -149.53 158.06 27.5 Favored Glycine 0 C--O 1.227 -0.302 0 C-N-CA 119.757 -1.211 . . . . 0.0 113.647 -179.424 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 416' ' ' VAL . . . . . 0.418 ' HB ' HD12 ' B' ' 401' ' ' ILE . 1.4 p -141.4 151.41 19.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.528 -0.336 . . . . 0.0 110.779 179.761 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.817 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . -165.18 142.91 8.05 Favored Glycine 0 C--O 1.228 -0.265 0 C-N-CA 120.957 -0.639 . . . . 0.0 111.732 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.52 ' CG ' ' OD1' ' B' ' 419' ' ' ASN . 4.7 ptm180 -60.64 -43.77 97.18 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -179.059 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.726 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.1 OUTLIER -100.19 34.35 2.37 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 178.893 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.755 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 51.09 -46.39 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 N-CA-C 114.746 1.387 . . . . 0.0 114.746 179.328 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.577 ' N ' HD12 ' B' ' 420' ' ' ILE . 0.0 OUTLIER -43.96 -58.61 2.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 118.784 0.72 . . . . 0.0 109.768 -179.71 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.817 HD13 ' CA ' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -45.06 -19.84 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 177.261 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.755 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -88.0 -49.26 7.17 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 177.607 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 424' ' ' GLY . . . . . 0.464 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -58.8 -44.79 95.68 Favored Glycine 0 C--N 1.339 0.708 0 C-N-CA 119.914 -1.136 . . . . 0.0 110.775 178.538 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.457 HG13 ' OD2' ' B' ' 367' ' ' ASP . 2.4 mp -67.25 -64.86 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 178.055 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.601 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -40.41 -26.56 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.816 179.039 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.625 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -73.91 -55.28 6.36 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.529 179.428 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 0.935 ' CB ' ' HB1' ' B' ' 370' ' ' ALA . . . -50.7 -50.57 54.82 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.028 0.442 . . . . 0.0 110.203 179.386 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.792 ' HA ' HD22 ' B' ' 432' ' ' LEU . 0.6 OUTLIER -58.7 -66.15 0.54 Allowed 'General case' 0 C--O 1.218 -0.553 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 178.094 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.502 ' C ' ' O ' ' B' ' 429' ' ' GLU . 0.3 OUTLIER -24.83 -42.29 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.267 179.512 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.564 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -78.23 -39.12 41.31 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.286 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.832 ' C ' HD23 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -78.75 8.42 5.44 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.146 0.498 . . . . 0.0 111.576 179.812 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 433' ' ' ARG . . . . . 0.552 ' N ' HD23 ' B' ' 432' ' ' LEU . 0.1 OUTLIER -87.64 -5.25 58.8 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.516 -179.426 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.47 ' OD2' ' HB2' ' B' ' 437' ' ' MET . 54.1 t0 -107.02 90.77 3.4 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.843 0.354 . . . . 0.0 111.283 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.551 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.2 OUTLIER -51.62 -53.3 39.93 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.019 179.94 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.551 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.2 OUTLIER -54.52 -43.66 72.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.973 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.545 ' CE ' ' HG ' ' B' ' 412' ' ' LEU . 16.6 tmm? -69.86 -55.4 9.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.852 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.82 HD21 ' HA ' ' B' ' 432' ' ' LEU . 69.7 mt -52.81 -62.79 1.42 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.276 0.56 . . . . 0.0 110.337 179.471 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 439' ' ' ASP . . . . . 0.431 ' O ' ' N ' ' B' ' 442' ' ' ALA . 14.1 t0 -50.53 -47.27 57.61 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.244 -0.889 . . . . 0.0 108.924 178.665 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.588 ' CZ ' ' NE2' ' B' ' 444' ' ' GLN . 0.5 OUTLIER -44.12 -41.16 5.44 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.264 179.565 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.627 ' HB3' HG23 ' B' ' 378' ' ' ILE . 43.2 m-85 -74.2 -31.83 62.81 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.436 179.502 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 442' ' ' ALA . . . . . 0.431 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -59.32 -61.94 2.25 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.903 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.01 -42.58 63.14 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 178.4 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.588 ' NE2' ' CZ ' ' B' ' 440' ' ' PHE . 3.1 mm-40 -54.48 -56.19 21.27 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.547 -0.752 . . . . 0.0 109.691 178.685 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.665 ' O ' HD11 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -46.43 -38.21 8.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.96 179.649 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -77.29 -40.19 45.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.765 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 447' ' ' ALA . . . . . 0.522 ' O ' ' N ' ' B' ' 449' ' ' PRO . . . -62.27 -59.73 4.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.842 -179.69 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.665 HD11 ' O ' ' B' ' 445' ' ' ARG . 0.5 OUTLIER -30.13 87.95 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.902 -179.881 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 449' ' ' PRO . . . . . 0.522 ' N ' ' O ' ' B' ' 447' ' ' ALA . 49.9 Cg_exo -60.06 132.64 45.61 Favored 'Trans proline' 0 CA--C 1.52 -0.206 0 C-N-CA 123.118 2.545 . . . . 0.0 112.633 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 41.28 -151.03 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.723 179.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 451' ' ' SER . . . . . 0.457 ' O ' ' HG3' ' B' ' 452' ' ' GLU . 0.0 OUTLIER -152.85 156.58 39.28 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.956 0.408 . . . . 0.0 111.315 179.955 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 452' ' ' GLU . . . . . 0.457 ' HG3' ' O ' ' B' ' 451' ' ' SER . 4.4 pt-20 36.96 68.27 0.28 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.873 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.175 -0.916 . . . . 0.0 110.875 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.836 " O5'" ' H8 ' ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.433 1.57 0 O4'-C1'-N19 111.205 3.005 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.833 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.269 0 O4'-C1'-N19 111.237 3.037 . 0.149 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.661 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.4 0 O4'-C1'-N19 111.132 2.932 . 0.147 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.642 " C5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.244 0 O4'-C1'-N19 111.124 2.924 . 0.112 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.622 " C5'" " O2'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.034 0 C5'-C4'-C3' 111.095 -2.937 . 0.165 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.62 ' OP1' HG21 ' B' ' 420' ' ' ILE . . . . . . . . 0 O4'--C4' 1.423 -2.531 0 O4'-C1'-N19 111.05 2.85 . 0.033 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.544 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.054 0 O4'-C1'-N19 111.502 3.302 . 0.18 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.687 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.268 0 O4'-C1'-N19 110.965 2.765 . 0.178 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.687 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.367 0 O4'-C1'-N19 111.142 2.942 . 0.142 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.679 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.002 0 C5'-C4'-C3' 110.965 -3.024 . 0.259 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.641 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.459 0 C5'-C4'-C3' 111.154 -2.897 . 0.048 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.67 " O2'" " C5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.43 -1.908 0 C5'-C4'-C3' 110.867 -3.089 . 0.043 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.67 " C5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.425 0 C3'-C2'-C1' 104.414 3.237 . 0.015 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.667 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.17 0 O4'-C1'-N19 111.114 2.914 . 0.036 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.702 ' N3 ' ' N6 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.432 -1.746 0 C5'-C4'-C3' 111.079 -2.947 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.635 " H1'" ' OP2' ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.427 -2.128 0 O4'-C1'-N19 111.47 3.27 OUTLIER-EPSILON 0.0 OUTLIER alpha 0.0 . . . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.635 ' OP2' " H1'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.436 1.812 0 C5'-C4'-C3' 110.998 -3.001 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.702 ' N6 ' ' N3 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.797 0 C5'-C4'-C3' 110.896 -3.069 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.688 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.08 0 C5'-C4'-C3' 110.992 -3.005 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.711 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.795 0 O4'-C1'-N19 111.451 3.251 . 0.062 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.704 ' H8 ' " O5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 P--O5' 1.614 2.061 0 O4'-C1'-N19 111.613 3.413 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.857 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.615 2.215 0 O4'-C1'-N19 111.032 2.832 . 0.017 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.653 " O2'" " C5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.14 0 O4'-C1'-N19 111.934 3.734 . 0.077 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.843 " O5'" ' H6 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 P--O5' 1.614 2.099 0 C5'-C4'-C3' 111.383 -2.745 . 0.041 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . 0.446 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.271 0 O4'-C1'-N19 111.158 2.958 . 0.229 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.467 " H2'" ' C6 ' ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.385 0 O4'-C1'-N19 111.232 3.032 . 0.482 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.886 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.055 0 O4'-C1'-N19 111.165 2.965 . 0.145 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.886 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.418 0 C3'-C2'-C1' 104.392 3.213 . 0.021 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.738 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.443 2.452 0 O4'-C1'-N19 111.179 2.979 . 0.208 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 0.83 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.158 0 O4'-C1'-N19 111.531 3.331 . 0.771 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 0.83 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.622 0 O4'-C1'-N19 111.348 3.148 . 0.162 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . 0.487 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.445 0 C5'-C4'-C3' 111.219 -2.854 . 0.352 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 364' ' ' GLY . . . . . 0.43 ' O ' ' N ' ' B' ' 366' ' ' LEU . . . . . . . . 0 N--CA 1.49 2.265 0 N-CA-C 112.51 -0.236 . . . . 0.0 112.51 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.03 87.05 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.792 0.329 . . . . 0.0 110.862 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 366' ' ' LEU . . . . . 0.43 ' N ' ' O ' ' B' ' 364' ' ' GLY . 0.3 OUTLIER -138.21 131.3 30.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.1 -179.712 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.535 ' O ' ' N ' ' B' ' 370' ' ' ALA . 4.8 t0 -57.58 -65.61 0.6 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.906 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.546 ' HA ' ' CE ' ' B' ' 371' ' ' LYS . 4.5 tmm? -36.86 -46.84 0.65 Allowed 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.338 0.589 . . . . 0.0 110.256 179.512 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -61.94 -40.71 96.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.684 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 1.006 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -63.79 -70.36 0.22 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.854 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.548 ' HG2' ' N ' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -35.67 -45.72 0.39 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.842 0.353 . . . . 0.0 110.294 -179.809 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.595 ' HG3' ' C2 ' ' A' ' 18' ' ' ' A' . 5.4 tmm_? -62.32 -39.78 94.17 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.861 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.766 HE22 HD22 ' B' ' 438' ' ' LEU . 4.3 tm0? -62.05 -58.4 7.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.281 0.562 . . . . 0.0 110.75 179.187 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 0.768 ' N ' HD23 ' B' ' 374' ' ' LEU . 0.9 OUTLIER -50.85 -70.39 0.09 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.992 -1.003 . . . . 0.0 113.136 -178.607 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 375' ' ' TYR . . . . . 0.551 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.0 m-85 -72.65 -49.92 28.58 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -177.305 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.55 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -65.61 -54.83 22.31 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -178.445 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.909 ' O ' HD13 ' B' ' 378' ' ' ILE . 3.3 tp -75.53 -26.43 58.05 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.909 HD13 ' O ' ' B' ' 377' ' ' LEU . 10.9 mm -125.18 -58.03 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.585 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.551 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -36.61 105.58 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.734 -0.746 . . . . 0.0 113.095 -179.302 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.758 ' CD2' HD12 ' B' ' 383' ' ' LEU . 18.1 p90 -119.58 171.48 8.34 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.758 0.313 . . . . 0.0 110.632 179.33 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 381' ' ' ALA . . . . . 0.526 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -62.9 104.42 0.55 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.087 -179.742 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 382' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 2.2 t 86.11 45.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.388 179.701 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.895 HD23 ' O ' ' B' ' 383' ' ' LEU . 6.3 tt -97.72 -33.62 11.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.596 179.584 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 384' ' ' ARG . . . . . 0.528 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 0.0 OUTLIER 65.53 62.14 0.67 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.914 179.857 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.839 ' HB2' HD22 ' B' ' 383' ' ' LEU . 1.6 tt -108.45 127.97 54.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.661 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 386' ' ' HIS . . . . . 0.697 ' N ' HD23 ' B' ' 385' ' ' LEU . 35.7 p-80 -154.8 156.79 36.89 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -179.275 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.621 ' OH ' HD13 ' B' ' 374' ' ' LEU . 3.6 m-85 -112.45 152.43 28.72 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 114.374 -1.285 . . . . 0.0 110.892 178.37 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 388' ' ' VAL . . . . . 0.988 HG23 ' HB3' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -135.51 135.14 51.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.712 179.613 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.4 m -95.22 127.13 41.03 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.457 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 0.982 HG23 HG23 ' B' ' 401' ' ' ILE . 31.6 m -131.8 157.85 43.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.198 -179.685 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.696 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 87.38 21.73 0.06 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.52 179.737 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.535 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER 0.98 116.83 0.0 OUTLIER Pre-proline 0 N--CA 1.472 0.663 0 O-C-N 124.001 0.813 . . . . 0.0 112.476 179.884 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.483 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 20.5 Cg_exo -61.78 162.73 20.84 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 122.472 2.115 . . . . 0.0 112.641 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 394' ' ' THR . . . . . 0.504 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 0.7 OUTLIER -155.49 166.11 34.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.159 -179.815 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -82.52 8.92 10.39 Favored 'General case' 0 CA--C 1.527 0.089 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.45 178.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 396' ' ' VAL . . . . . 0.435 HG22 ' OG1' ' B' ' 394' ' ' THR . 19.1 m -129.61 11.0 2.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.655 0.74 . . . . 0.0 109.208 178.069 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 397' ' ' ASP . . . . . 0.414 ' H ' ' HD3' ' B' ' 398' ' ' PRO . 0.4 OUTLIER 168.68 60.07 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 114.605 -1.18 . . . . 0.0 109.297 -179.908 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.504 ' HA ' ' H ' ' B' ' 394' ' ' THR . 90.3 Cg_exo -43.99 -54.58 3.71 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.047 2.498 . . . . 0.0 112.759 -179.594 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.552 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 18.9 p30 -25.27 132.06 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.989 -178.483 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 400' ' ' SER . . . . . 0.471 ' HB2' ' HG3' ' B' ' 393' ' ' PRO . 4.5 t -137.94 152.84 49.36 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.795 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 0.982 HG23 HG23 ' B' ' 390' ' ' VAL . 0.3 OUTLIER -114.92 141.21 32.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.067 0.46 . . . . 0.0 111.201 -179.631 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.673 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -106.27 158.24 6.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.431 179.672 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 0.988 ' HB3' HG23 ' B' ' 388' ' ' VAL . 63.4 tt0 -125.47 114.41 18.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.884 179.249 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.614 ' HB3' ' CZ ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -99.8 103.31 14.93 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.278 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.59 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.1 OUTLIER -144.41 169.36 18.07 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.327 -179.25 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.662 HG11 ' HG ' ' B' ' 385' ' ' LEU . 0.9 OUTLIER -149.76 -177.25 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.336 -178.942 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 407' ' ' GLY . . . . . 0.514 ' N ' HG23 ' B' ' 406' ' ' VAL . . . 56.57 -104.52 0.38 Allowed Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.658 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -155.25 18.44 0.42 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.874 0.369 . . . . 0.0 110.936 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 169.32 33.55 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 121.001 -0.619 . . . . 0.0 112.284 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.59 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 1.2 m -120.07 111.72 18.24 Favored 'General case' 0 C--O 1.22 -0.498 0 O-C-N 123.0 -0.118 . . . . 0.0 110.756 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 57.8 t -105.14 104.18 16.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.65 0.262 . . . . 0.0 110.53 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.715 ' N ' HD13 ' B' ' 412' ' ' LEU . 0.0 OUTLIER -62.33 -26.89 68.68 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 179.345 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 413' ' ' GLY . . . . . 0.479 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 172.44 -171.57 44.37 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.121 -1.037 . . . . 0.0 113.181 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.461 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -145.79 147.68 32.13 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.664 -0.268 . . . . 0.0 110.704 -179.671 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.529 ' HA2' ' HG2' ' B' ' 426' ' ' ARG . . . -140.72 150.36 21.64 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 119.9 -1.143 . . . . 0.0 112.936 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 416' ' ' VAL . . . . . 0.779 ' HB ' HD12 ' B' ' 401' ' ' ILE . 1.6 p -152.02 137.3 10.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.788 0.327 . . . . 0.0 111.355 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.942 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -149.74 177.36 27.93 Favored Glycine 0 C--O 1.226 -0.344 0 C-N-CA 120.856 -0.688 . . . . 0.0 111.962 179.676 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.496 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 4.4 ptt85 -85.5 -45.52 11.72 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -179.617 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.684 ' H ' HD11 ' B' ' 422' ' ' ILE . 14.8 t30 -98.85 39.68 1.25 Allowed 'General case' 0 C--O 1.223 -0.332 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.686 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 1.0 OUTLIER 46.34 -47.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 179.069 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.663 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -42.35 -58.22 2.28 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 118.378 0.536 . . . . 0.0 109.893 -179.081 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.942 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -46.69 -17.57 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.567 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.916 178.246 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.686 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -86.49 -49.84 7.29 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 424' ' ' GLY . . . . . 0.501 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -57.33 -46.48 91.75 Favored Glycine 0 C--N 1.34 0.774 0 C-N-CA 119.824 -1.179 . . . . 0.0 110.781 178.722 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.593 ' N ' HD12 ' B' ' 425' ' ' ILE . 1.3 mp -66.55 -65.0 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.068 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.615 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -39.7 -31.62 0.11 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.045 178.691 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.58 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -63.7 -59.88 4.02 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.462 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 1.006 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -58.95 -54.32 48.43 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 178.296 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.658 ' OE2' ' HB2' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -53.12 -18.09 1.97 Allowed 'General case' 0 C--N 1.334 -0.076 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.339 178.602 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.525 ' ND2' ' O ' ' B' ' 426' ' ' ARG . 0.7 OUTLIER -82.07 -36.39 27.7 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.311 178.985 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.507 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -71.15 -37.17 72.25 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -178.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.865 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -83.85 12.2 6.44 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.044 179.968 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -99.17 -8.98 24.34 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.389 -179.352 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.493 ' O ' ' HG ' ' B' ' 438' ' ' LEU . 29.8 t0 -108.68 87.36 2.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.068 0.461 . . . . 0.0 111.203 -179.602 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.568 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -53.0 -53.15 54.4 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.088 -179.963 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.568 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 7.5 mttm -52.15 -46.72 65.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.99 -179.597 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.479 ' O ' ' HB3' ' B' ' 440' ' ' PHE . 14.3 tmm? -68.4 -50.85 49.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.979 0.419 . . . . 0.0 110.338 179.476 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.865 HD11 ' HA ' ' B' ' 432' ' ' LEU . 58.3 mt -51.73 -62.37 1.67 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.546 179.419 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 439' ' ' ASP . . . . . 0.451 ' O ' ' HB3' ' B' ' 442' ' ' ALA . 48.9 t0 -57.37 -39.18 75.48 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.232 178.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.48 ' CD1' ' C ' ' B' ' 440' ' ' PHE . 0.0 OUTLIER -45.94 -49.76 15.43 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.189 179.497 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.475 ' HA ' ' HB2' ' B' ' 444' ' ' GLN . 60.8 m-85 -65.15 -37.42 87.34 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.504 179.313 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 442' ' ' ALA . . . . . 0.455 ' O ' ' N ' ' B' ' 445' ' ' ARG . . . -45.52 -62.07 1.43 Allowed 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 178.23 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -48.36 -47.66 37.07 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 178.139 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.967 ' O ' HG23 ' B' ' 448' ' ' ILE . 8.0 mm-40 -65.67 -5.7 9.23 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.046 178.802 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.54 ' O ' ' CG1' ' B' ' 448' ' ' ILE . 0.0 OUTLIER -89.51 -42.25 11.57 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.1 179.79 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -71.46 -31.14 66.82 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.986 179.286 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 447' ' ' ALA . . . . . 0.462 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -67.75 -63.63 1.02 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.409 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.967 HG23 ' O ' ' B' ' 444' ' ' GLN . 1.1 pt -27.45 132.77 0.16 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.95 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -74.89 2.6 6.39 Favored 'Trans proline' 0 N--CA 1.465 -0.163 0 C-N-CA 122.821 2.347 . . . . 0.0 112.344 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 39.8 58.0 2.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.69 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 9.3 t -65.0 -40.52 95.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.034 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 70.07 29.64 3.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.982 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.916 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.765 HO2' ' H8 ' ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.779 0 C3'-C2'-C1' 104.709 3.566 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.765 ' H8 ' HO2' ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.155 0 O4'-C1'-N19 111.113 2.913 . 0.231 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.579 " O2'" " O5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.384 0 C5'-C4'-C3' 111.024 -2.984 . 0.165 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.579 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.358 0 C5'-C4'-C3' 111.055 -2.963 . 0.077 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.552 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.002 0 O4'-C1'-N19 111.2 3.0 . 0.194 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.521 ' OP1' ' CG ' ' B' ' 393' ' ' PRO . . . . . . . . 0 O4'--C4' 1.424 -2.426 0 C5'-C4'-C3' 111.099 -2.934 . 0.032 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.582 " O5'" ' H6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.22 0 O4'-C1'-N19 111.556 3.356 . 0.175 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.446 ' C6 ' " H2'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.443 2.433 0 O4'-C1'-N19 111.149 2.949 . 0.269 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.445 " H2'" ' C6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.334 0 O4'-C1'-N19 111.215 3.015 . 0.108 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.663 " O5'" ' H6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.436 1.829 0 C5'-C4'-C3' 111.186 -2.876 . 0.086 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.613 " O2'" " O5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.43 0 O4'-C1'-N19 111.169 2.969 . 0.018 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.763 ' H6 ' " O5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 P--O5' 1.612 1.935 0 O4'-C1'-N19 111.068 2.868 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.74 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.542 0 C3'-C2'-C1' 104.885 3.761 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.696 ' C4 ' ' C4 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.554 0 C5'-C4'-C3' 111.165 -2.89 . 0.02 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.719 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.437 1.894 0 O4'-C1'-N19 111.114 2.914 . 0.039 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.719 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.432 -1.772 0 O4'-C1'-N19 111.389 3.189 . 0.3 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.646 ' C2 ' ' NH1' ' B' ' 372' ' ' ARG . . . . . . . . 0 O4'--C4' 1.429 -1.972 0 O4'-C1'-N19 111.344 3.144 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.781 " O5'" ' H8 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.708 0 C5'-C4'-C3' 110.968 -3.022 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.709 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.089 0 C5'-C4'-C3' 111.069 -2.954 . 0.054 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.739 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.846 0 C5'-C4'-C3' 111.071 -2.952 . 0.165 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.709 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.658 0 C3'-C2'-C1' 104.855 3.728 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.831 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.994 0 O4'-C1'-N19 111.168 2.968 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.781 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.334 0 O4'-C1'-N19 111.46 3.26 . 0.048 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.708 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.107 0 O4'-C1'-N19 110.817 2.617 . 0.098 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . 0.451 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.33 0 O4'-C1'-N19 111.275 3.075 . 0.273 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.563 HO2' " C5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.512 0 O4'-C1'-N19 111.211 3.011 . 0.09 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.88 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.436 1.839 0 O4'-C1'-N19 111.112 2.912 . 0.117 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.88 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.499 0 C3'-C2'-C1' 104.686 3.54 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.796 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.271 0 O4'-C1'-N19 111.252 3.052 . 0.14 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 1.002 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.227 0 O4'-C1'-N19 111.303 3.103 . 0.458 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 1.002 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.636 0 O4'-C1'-N19 111.108 2.908 . 0.166 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.604 0 O4'-C1'-N19 111.137 2.937 . 0.588 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.108 0 N-CA-C 112.485 -0.246 . . . . 0.0 112.485 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 365' ' ' SER . . . . . 0.461 ' HB3' ' HG ' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -121.72 30.49 6.66 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.837 0.351 . . . . 0.0 110.915 179.859 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 366' ' ' LEU . . . . . 0.792 HD12 ' H ' ' B' ' 367' ' ' ASP . 0.1 OUTLIER -75.34 173.1 11.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.34 179.786 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.792 ' H ' HD12 ' B' ' 366' ' ' LEU . 30.0 t70 -41.93 -77.45 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.426 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.559 ' HA ' ' CD ' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -36.11 -41.72 0.27 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.52 179.414 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 369' ' ' ASN . . . . . 0.512 ' N ' ' HG3' ' B' ' 368' ' ' MET . 2.8 m-80 -63.96 -45.82 87.41 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.034 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 1.002 ' HB3' ' HB1' ' B' ' 428' ' ' ALA . . . -61.92 -68.53 0.31 Allowed 'General case' 0 C--O 1.223 -0.322 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 179.441 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.618 ' HE2' ' N3 ' ' A' ' 20' ' ' ' A' . 0.0 OUTLIER -35.64 -44.89 0.34 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.795 0.331 . . . . 0.0 110.547 179.946 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.646 ' NH1' ' C2 ' ' A' ' 17' ' ' ' A' . 0.0 OUTLIER -64.64 -36.03 82.92 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-O 121.329 0.585 . . . . 0.0 110.247 179.209 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.963 ' O ' HG23 ' B' ' 378' ' ' ILE . 1.5 tm0? -62.51 -46.1 89.95 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.98 179.46 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 1.038 HD12 HD21 ' B' ' 385' ' ' LEU . 0.1 OUTLIER -71.71 -65.73 0.72 Allowed 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -178.126 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 375' ' ' TYR . . . . . 0.633 ' CE1' HD11 ' B' ' 385' ' ' LEU . 2.5 m-85 -78.96 -7.25 57.87 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.337 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.556 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.2 OUTLIER -128.2 4.13 5.79 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.851 0.686 . . . . 0.0 112.851 -179.12 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.846 HD23 ' CD ' ' B' ' 373' ' ' GLN . 49.4 tp -152.52 -2.74 0.25 Allowed 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -179.825 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.963 HG23 ' O ' ' B' ' 373' ' ' GLN . 0.7 OUTLIER -131.52 -51.93 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.101 0 C-N-CA 119.442 -0.903 . . . . 0.0 112.324 179.602 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.795 ' CA ' HD21 ' B' ' 383' ' ' LEU . . . -114.36 -151.45 10.36 Favored Glycine 0 N--CA 1.445 -0.765 0 C-N-CA 119.529 -1.32 . . . . 0.0 113.607 -179.117 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.55 ' CZ ' ' CG2' ' B' ' 448' ' ' ILE . 0.1 OUTLIER -155.09 -84.47 0.06 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.175 -0.513 . . . . 0.0 110.124 -179.389 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -170.59 25.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.692 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 382' ' ' SER . . . . . 0.493 ' O ' ' HG2' ' B' ' 384' ' ' ARG . 0.1 OUTLIER -131.73 -43.71 0.99 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.668 0.27 . . . . 0.0 111.034 179.874 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.822 HD12 ' N ' ' B' ' 384' ' ' ARG . 1.1 pp -61.32 -15.01 31.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.949 0.404 . . . . 0.0 110.772 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 384' ' ' ARG . . . . . 0.822 ' N ' HD12 ' B' ' 383' ' ' LEU . 15.0 mmt180 70.1 66.93 0.22 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.693 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 1.038 HD21 HD12 ' B' ' 374' ' ' LEU . 0.0 OUTLIER -102.12 132.8 47.8 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.88 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 386' ' ' HIS . . . . . 0.986 ' N ' HD22 ' B' ' 385' ' ' LEU . 30.8 p-80 -176.31 -177.39 0.86 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.627 0.727 . . . . 0.0 112.684 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.564 ' CE2' ' HB3' ' B' ' 404' ' ' CYS . 2.6 m-85 -118.96 165.18 14.41 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-N 114.749 -1.114 . . . . 0.0 110.156 178.617 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 388' ' ' VAL . . . . . 0.531 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -149.62 112.3 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 CA-C-O 121.484 0.659 . . . . 0.0 112.047 179.388 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 13.2 m -72.76 130.01 39.51 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.974 179.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 0.828 HG23 HG23 ' B' ' 401' ' ' ILE . 29.6 m -136.96 153.22 29.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.985 -179.672 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.53 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 86.16 28.47 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.351 -179.406 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.507 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.8 OUTLIER -8.58 119.06 0.03 OUTLIER Pre-proline 0 N--CA 1.467 0.41 0 O-C-N 124.148 0.905 . . . . 0.0 112.587 -179.717 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.521 ' CG ' ' OP1' ' A' ' 6' ' ' ' A' . 2.0 Cg_endo -49.09 167.68 0.13 Allowed 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.703 2.269 . . . . 0.0 112.591 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 394' ' ' THR . . . . . 0.431 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 52.2 p -150.33 158.86 44.62 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.39 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -77.65 5.7 8.72 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 120.962 0.41 . . . . 0.0 111.139 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 15.2 m -133.22 12.98 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.535 0.683 . . . . 0.0 109.387 178.33 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 174.22 56.93 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.004 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.51 ' O ' ' C ' ' B' ' 399' ' ' ASN . 60.0 Cg_exo -35.72 -57.1 0.54 Allowed 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 123.081 2.52 . . . . 0.0 112.71 -179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.553 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 2.0 m-20 -13.52 125.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.924 -179.404 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 38.7 t -132.33 142.37 49.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.781 179.199 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 0.828 HG23 HG23 ' B' ' 390' ' ' VAL . 0.1 OUTLIER -109.6 134.13 52.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-O 121.104 0.478 . . . . 0.0 111.328 -179.366 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.908 HG21 ' O ' ' B' ' 423' ' ' ALA . 2.0 t -98.16 154.73 3.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.76 179.542 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 0.531 ' CB ' HG23 ' B' ' 388' ' ' VAL . 8.4 mm-40 -130.7 104.29 7.1 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.367 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.564 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -92.5 107.22 19.05 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.659 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.521 ' HA ' ' O ' ' B' ' 410' ' ' THR . 10.5 ptm180 -147.21 164.95 31.52 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.894 -179.423 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.6 HG12 ' HA ' ' B' ' 385' ' ' LEU . 1.6 m -144.2 144.44 22.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.01 -179.544 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 68.56 3.86 35.66 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.42 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 67.11 12.31 8.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.704 0.288 . . . . 0.0 110.799 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -133.68 -5.19 2.91 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.474 -0.869 . . . . 0.0 113.239 -179.633 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.521 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 63.8 m -130.06 122.98 29.4 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-N 116.992 0.396 . . . . 0.0 111.935 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 9.6 t -107.26 96.07 4.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.834 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.554 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -54.53 -21.86 11.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.011 0.434 . . . . 0.0 110.301 179.648 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 160.12 -161.51 32.52 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.69 -0.766 . . . . 0.0 112.299 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 414' ' ' THR . . . . . 0.504 ' OG1' HD11 ' B' ' 401' ' ' ILE . 8.8 t -160.25 167.68 27.03 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.121 0.486 . . . . 0.0 111.471 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.51 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -141.3 154.61 24.69 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.654 -0.784 . . . . 0.0 113.582 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 416' ' ' VAL . . . . . 0.773 ' CG2' HD12 ' B' ' 401' ' ' ILE . 85.9 t -148.15 100.86 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 120.761 0.315 . . . . 0.0 110.777 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.957 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -113.95 162.53 12.36 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.626 -0.797 . . . . 0.0 111.768 179.756 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.425 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.0 OUTLIER -83.38 -50.68 8.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 117.125 0.462 . . . . 0.0 111.027 179.994 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.952 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.5 OUTLIER -80.01 -23.93 41.17 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 120.972 -0.291 . . . . 0.0 110.767 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.952 HG23 ' O ' ' B' ' 419' ' ' ASN . 1.2 pp 110.54 -39.77 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 124.523 1.129 . . . . 0.0 110.842 -179.631 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.558 ' N ' HD12 ' B' ' 420' ' ' ILE . 0.3 OUTLIER -45.86 -63.08 1.06 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.994 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.957 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -45.34 -24.45 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.282 177.316 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.908 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -72.75 -51.76 17.81 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.092 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 424' ' ' GLY . . . . . 0.501 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -64.0 -54.6 29.41 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.25 -0.976 . . . . 0.0 111.322 179.341 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.655 ' N ' HD13 ' B' ' 425' ' ' ILE . 2.1 mm -62.6 -71.08 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.575 0 CA-C-N 115.662 -0.269 . . . . 0.0 111.113 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.539 ' CG ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -46.34 -25.4 0.63 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.944 0.402 . . . . 0.0 110.83 -178.549 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.702 ' HB2' ' O ' ' B' ' 423' ' ' ALA . . . -62.56 -54.58 37.64 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 176.576 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 1.002 ' HB1' ' HB3' ' B' ' 370' ' ' ALA . . . -53.59 -50.84 64.76 Favored 'General case' 0 C--O 1.243 0.753 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 177.62 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.508 ' HA ' ' CD1' ' B' ' 432' ' ' LEU . 29.2 mt-10 -61.38 -8.54 4.08 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 115.085 -0.962 . . . . 0.0 111.402 179.168 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.537 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 24.8 m120 -86.48 -39.6 16.12 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.537 178.431 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.561 ' CB ' ' OH ' ' B' ' 387' ' ' TYR . . . -70.87 -34.39 71.56 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 -179.363 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.722 ' CD1' ' HB2' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -85.82 14.51 5.86 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.383 -0.527 . . . . 0.0 111.356 -179.897 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 8.2 ttt180 -94.89 -3.71 48.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.178 -179.46 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.548 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 18.2 m-20 -113.59 73.1 0.8 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.328 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.555 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 6.5 ptmt -41.89 -52.65 4.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.856 0.36 . . . . 0.0 110.579 179.713 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.555 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 1.4 mtpp -55.87 -45.17 78.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.212 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.554 ' SD ' HD12 ' B' ' 412' ' ' LEU . 15.5 tmm? -65.82 -52.3 51.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.082 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.791 HD22 ' OE1' ' B' ' 373' ' ' GLN . 24.3 mt -53.62 -65.37 0.58 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.617 179.297 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -46.51 -49.09 18.99 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.731 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.534 ' CE2' ' CZ ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -48.37 -42.23 31.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.532 0.682 . . . . 0.0 109.377 179.999 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.589 ' CB ' ' HB ' ' B' ' 378' ' ' ILE . 45.4 m-85 -73.02 -37.88 66.76 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.2 179.707 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -51.7 -59.47 4.25 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.409 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 3.4 ttmt -49.08 -45.24 42.82 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.504 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.8 OUTLIER -54.11 -49.04 70.04 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.058 178.543 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.798 ' O ' HD11 ' B' ' 448' ' ' ILE . 0.1 OUTLIER -57.72 -27.71 63.21 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.048 179.786 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -74.83 -41.61 59.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.976 0.417 . . . . 0.0 110.509 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 447' ' ' ALA . . . . . 0.478 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -70.4 -78.75 0.07 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.124 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.798 HD11 ' O ' ' B' ' 445' ' ' ARG . 0.2 OUTLIER 23.56 95.39 0.04 OUTLIER Pre-proline 0 N--CA 1.463 0.212 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.767 -179.844 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 449' ' ' PRO . . . . . 0.445 ' O ' ' HB2' ' B' ' 450' ' ' ARG . 50.3 Cg_endo -84.45 117.19 2.07 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 123.085 2.523 . . . . 0.0 112.306 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 450' ' ' ARG . . . . . 0.445 ' HB2' ' O ' ' B' ' 449' ' ' PRO . 0.0 OUTLIER 177.66 -67.15 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.139 -179.93 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -105.95 -22.33 12.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.174 -179.69 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 6.3 mp0 -137.61 108.81 6.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.935 0.398 . . . . 0.0 111.051 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 28.7 t . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.858 179.971 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ' G' . . . . . 0.533 HO5' ' H8 ' ' A' ' 1' ' ' ' G' . . . . . . . . 0 C2'--C1' 1.511 -1.673 0 C5'-C4'-C3' 110.867 -3.089 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ' G' . . . . . 0.757 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.222 0 O4'-C1'-N19 111.185 2.985 . 0.119 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ' G' . . . . . 0.757 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.389 0 O4'-C1'-N19 111.144 2.944 . 0.117 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ' A' . . . . . 0.514 " H2'" ' C6 ' ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.328 0 O4'-C1'-N19 110.965 2.765 . 0.11 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ' U' . . . . . 0.62 " O2'" " H5'" ' A' ' 6' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.094 0 C5'-C4'-C3' 111.16 -2.893 . 0.096 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ' A' . . . . . 0.62 " H5'" " O2'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.313 0 C5'-C4'-C3' 111.177 -2.882 . 0.33 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ' C' . . . . . 0.548 ' C4 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.669 0 C3'-C2'-C1' 104.9 3.778 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ' C' . . . . . 0.564 " O2'" " O5'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.747 0 C3'-C2'-C1' 104.823 3.693 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ' A' . . . . . 0.876 " O2'" " H5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.214 0 O4'-C1'-N19 111.281 3.081 . 0.064 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ' U' . . . . . 0.876 " H5'" " O2'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.696 0 C3'-C2'-C1' 104.662 3.513 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ' G' . . . . . 0.599 " O5'" " O2'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.491 0 C5'-C4'-C3' 111.05 -2.966 . 0.038 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ' U' . . . . . 0.897 ' H6 ' " O5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.435 1.759 0 C5'-C4'-C3' 110.802 -3.132 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ' U' . . . . . 0.779 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.489 0 C3'-C2'-C1' 104.885 3.761 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ' C' . . . . . 0.677 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.339 0 C5'-C4'-C3' 111.147 -2.902 . 0.087 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ' A' . . . . . 0.949 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.426 0 C5'-C4'-C3' 111.068 -2.955 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ' G' . . . . . 0.949 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.427 0 C5'-C4'-C3' 110.7 -3.2 OUTLIER-EPSILON 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ' A' . . . . . 0.636 ' OP2' " H4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.436 0 C3'-C2'-C1' 104.209 3.01 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ' A' . . . . . 0.6 ' N6 ' ' N3 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.026 0 O4'-C1'-N19 110.852 2.652 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ' G' . . . . . 0.55 ' H21' ' NH2' ' B' ' 372' ' ' ARG . . . . . . . . 0 O4'--C4' 1.426 -2.21 0 C5'-C4'-C3' 111.172 -2.886 . 0.397 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ' A' . . . . . 0.739 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 P--O5' 1.612 1.884 0 C5'-C4'-C3' 111.197 -2.869 . 0.191 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ' A' . . . . . 0.729 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.457 0 C3'-C2'-C1' 104.612 3.457 . 0.013 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ' C' . . . . . 0.899 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.436 1.869 0 O4'-C1'-N19 111.028 2.828 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ' G' . . . . . 0.779 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.126 0 O4'-C1'-N19 111.323 3.123 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ' U' . . . . . 0.779 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.615 0 C3'-C2'-C1' 104.854 3.726 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ' G' . . . . . 0.608 " O5'" " O2'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.28 0 O4'-C1'-N19 110.998 2.798 . 0.034 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ' G' . . . . . 0.706 " O2'" " H5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.384 0 O4'-C1'-N19 111.159 2.959 . 0.454 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ' U' . . . . . 0.707 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.442 2.294 0 O4'-C1'-N19 111.367 3.167 . 0.179 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ' A' . . . . . 0.707 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.665 0 C3'-C2'-C1' 104.692 3.547 . 0.024 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ' U' . . . . . 0.881 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.442 2.343 0 O4'-C1'-N19 111.169 2.969 . 0.184 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ' C' . . . . . 0.952 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.239 0 O4'-C1'-N19 111.514 3.314 . 0.123 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ' U' . . . . . 0.952 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.611 0 O4'-C1'-N19 111.244 3.044 . 0.171 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.703 0 C5'-C4'-C3' 111.123 -2.918 . 0.508 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.261 0 N-CA-C 112.469 -0.252 . . . . 0.0 112.469 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 365' ' ' SER . . . . . 0.462 ' HB2' ' OE2' ' B' ' 429' ' ' GLU . 12.1 m -90.28 47.52 1.45 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.917 0.389 . . . . 0.0 110.822 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 366' ' ' LEU . . . . . 0.513 ' O ' ' HB2' ' B' ' 369' ' ' ASN . 6.7 tp -41.18 150.49 0.08 Allowed 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.982 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 367' ' ' ASP . . . . . 0.479 ' HB3' HG13 ' B' ' 425' ' ' ILE . 1.0 OUTLIER -46.84 -72.86 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 179.133 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 368' ' ' MET . . . . . 0.559 ' SD ' ' N1 ' ' A' ' 18' ' ' ' A' . 3.5 tmm? -34.41 -42.48 0.14 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.773 179.591 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 369' ' ' ASN . . . . . 0.545 ' N ' ' HE3' ' B' ' 368' ' ' MET . 90.7 m-20 -59.99 -50.5 73.49 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.8 0.333 . . . . 0.0 110.704 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 370' ' ' ALA . . . . . 0.71 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -56.38 -68.31 0.22 Allowed 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 178.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 371' ' ' LYS . . . . . 0.425 ' C ' ' O ' ' B' ' 370' ' ' ALA . 2.5 mttm -33.85 -51.3 0.4 Allowed 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.9 179.809 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 372' ' ' ARG . . . . . 0.591 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.2 OUTLIER -56.64 -38.33 71.98 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.712 -179.843 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 373' ' ' GLN . . . . . 0.56 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.4 OUTLIER -62.87 -57.14 11.85 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.696 0.76 . . . . 0.0 110.159 178.955 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 374' ' ' LEU . . . . . 1.091 HD11 ' CB ' ' B' ' 428' ' ' ALA . 1.8 mt -48.8 -74.75 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 1.5 m-30 -98.14 4.39 49.05 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 -176.542 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 376' ' ' SER . . . . . 0.591 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.1 OUTLIER -116.2 -2.04 12.26 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.077 0.465 . . . . 0.0 110.211 178.705 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 377' ' ' LEU . . . . . 0.544 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.4 OUTLIER -133.42 -39.04 0.92 Allowed 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.082 177.901 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 378' ' ' ILE . . . . . 0.436 ' C ' ' O ' ' B' ' 374' ' ' LEU . 0.7 OUTLIER -127.15 -142.79 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.672 179.501 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 379' ' ' GLY . . . . . 0.51 ' O ' ' O ' ' B' ' 380' ' ' TYR . . . 93.26 -22.62 33.85 Favored Glycine 0 C--N 1.332 0.342 0 C-N-CA 120.535 -0.84 . . . . 0.0 113.139 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 380' ' ' TYR . . . . . 0.633 ' CD2' ' HB3' ' B' ' 383' ' ' LEU . 0.2 OUTLIER 36.93 -175.23 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 115.258 1.577 . . . . 0.0 115.258 179.57 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -123.42 -21.46 5.31 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 113.734 -1.575 . . . . 0.0 111.183 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 37.9 t -160.14 44.84 0.22 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.136 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 383' ' ' LEU . . . . . 0.818 HD13 ' C ' ' B' ' 383' ' ' LEU . 0.0 OUTLIER -114.05 -3.99 13.24 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.861 0.362 . . . . 0.0 111.018 178.749 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 384' ' ' ARG . . . . . 0.777 ' N ' HD13 ' B' ' 383' ' ' LEU . 11.9 tpt180 75.86 71.63 0.08 Allowed 'General case' 0 C--O 1.227 -0.127 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 178.327 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 385' ' ' LEU . . . . . 0.661 ' HB2' HD11 ' B' ' 383' ' ' LEU . 7.3 tt -135.32 123.88 23.57 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.451 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 386' ' ' HIS . . . . . 0.492 ' N ' HD23 ' B' ' 385' ' ' LEU . 7.5 p-80 -158.91 146.17 17.47 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 -178.734 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 387' ' ' TYR . . . . . 0.745 ' CZ ' HD13 ' B' ' 374' ' ' LEU . 39.2 m-85 -96.56 132.77 41.82 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 114.095 -1.411 . . . . 0.0 110.823 178.172 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -122.17 130.82 74.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.52 179.575 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.1 m -91.96 121.17 33.3 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.291 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 390' ' ' VAL . . . . . 1.01 HG23 HG23 ' B' ' 401' ' ' ILE . 27.5 m -128.9 152.35 36.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.309 -179.265 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 391' ' ' LYS . . . . . 0.65 ' HB2' HG22 ' B' ' 401' ' ' ILE . 4.7 tmtt? 87.66 24.87 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.311 179.572 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 392' ' ' LYS . . . . . 0.542 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.2 OUTLIER -4.72 116.95 0.02 OUTLIER Pre-proline 0 N--CA 1.473 0.696 0 O-C-N 124.016 0.822 . . . . 0.0 111.962 -179.964 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 393' ' ' PRO . . . . . 0.554 ' CG ' HG21 ' B' ' 420' ' ' ILE . 15.7 Cg_exo -65.35 162.03 35.31 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.351 2.034 . . . . 0.0 112.542 -179.345 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 394' ' ' THR . . . . . 0.456 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 2.3 p -150.08 164.82 34.56 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.478 -0.783 . . . . 0.0 112.022 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 395' ' ' ALA . . . . . 0.512 ' CB ' ' O2 ' ' A' ' 29' ' ' ' U' . . . -81.6 5.29 18.57 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.603 179.451 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 396' ' ' VAL . . . . . 0.591 HG23 ' OD2' ' B' ' 397' ' ' ASP . 26.1 m -123.41 11.54 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 CA-C-O 121.53 0.681 . . . . 0.0 109.462 178.748 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 397' ' ' ASP . . . . . 0.591 ' OD2' HG23 ' B' ' 396' ' ' VAL . 2.0 p30 163.95 59.33 0.0 OUTLIER Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 114.803 -1.089 . . . . 0.0 109.841 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 398' ' ' PRO . . . . . 0.541 ' HB2' ' O ' ' B' ' 418' ' ' ARG . 21.5 Cg_exo -32.91 -57.4 0.31 Allowed 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 123.069 2.513 . . . . 0.0 112.368 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 399' ' ' ASN . . . . . 0.52 ' C ' ' O ' ' B' ' 398' ' ' PRO . 15.7 m120 -5.23 120.77 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 114.948 -1.023 . . . . 0.0 112.256 179.668 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 400' ' ' SER . . . . . 0.512 ' CB ' ' HG3' ' B' ' 393' ' ' PRO . 0.3 OUTLIER -144.15 139.4 28.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.886 179.949 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 401' ' ' ILE . . . . . 1.01 HG23 HG23 ' B' ' 390' ' ' VAL . 1.9 tp -110.34 143.46 20.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.717 -179.537 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 402' ' ' VAL . . . . . 0.68 ' HB ' ' HB2' ' B' ' 427' ' ' ALA . 0.4 OUTLIER -112.78 148.99 15.41 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.651 -179.568 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 403' ' ' GLU . . . . . 0.517 ' OE1' HG11 ' B' ' 411' ' ' VAL . 2.1 mm-40 -127.74 128.72 45.86 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.745 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 404' ' ' CYS . . . . . 0.606 ' HB3' ' HA3' ' B' ' 413' ' ' GLY . 18.7 t -118.85 104.86 10.94 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 177.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.571 ' HB2' HG22 ' B' ' 411' ' ' VAL . 3.1 ttp180 -110.96 158.2 19.03 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 124.126 0.891 . . . . 0.0 111.666 -178.3 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 406' ' ' VAL . . . . . 0.683 HG23 ' HB ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -154.7 159.62 3.0 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.668 -179.6 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 64.93 -94.82 0.18 Allowed Glycine 0 CA--C 1.518 0.259 0 CA-C-N 115.173 -0.921 . . . . 0.0 113.211 179.487 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -141.61 20.55 2.19 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 111.555 0.206 . . . . 0.0 111.555 -179.392 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 151.82 -14.46 0.79 Allowed Glycine 0 C--N 1.33 0.195 0 C-N-CA 120.234 -0.984 . . . . 0.0 112.96 179.746 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 410' ' ' THR . . . . . 0.683 ' HB ' HG23 ' B' ' 406' ' ' VAL . 95.0 m -53.58 108.77 0.37 Allowed 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 411' ' ' VAL . . . . . 0.571 HG22 ' HB2' ' B' ' 405' ' ' ARG . 24.2 t -124.07 106.61 17.21 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.742 0 CA-C-O 122.006 0.908 . . . . 0.0 111.523 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.461 ' O ' ' HB3' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -102.62 -38.99 7.26 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 113.704 -1.589 . . . . 0.0 108.942 -179.878 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 413' ' ' GLY . . . . . 0.606 ' HA3' ' HB3' ' B' ' 404' ' ' CYS . . . -72.23 98.64 0.82 Allowed Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.069 -1.062 . . . . 0.0 112.535 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 414' ' ' THR . . . . . . . . . . . . . 3.7 m -134.79 93.68 3.06 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 415' ' ' GLY . . . . . 0.804 ' O ' HD12 ' B' ' 401' ' ' ILE . . . -133.71 147.3 18.99 Favored Glycine 0 C--O 1.226 -0.363 0 C-N-CA 119.523 -1.322 . . . . 0.0 114.394 -178.485 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 10.5 p -127.87 154.1 38.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.312 -0.444 . . . . 0.0 110.173 179.566 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.873 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -165.1 155.72 27.27 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 119.948 -1.12 . . . . 0.0 113.039 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 418' ' ' ARG . . . . . 0.541 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.0 OUTLIER -70.77 -41.98 71.0 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.867 0.365 . . . . 0.0 111.361 -179.939 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 419' ' ' ASN . . . . . 0.808 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.1 OUTLIER -100.36 23.97 9.46 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.184 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 420' ' ' ILE . . . . . 0.759 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 56.51 -43.09 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 179.247 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 421' ' ' LYS . . . . . 0.626 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -45.17 -57.71 3.74 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 179.282 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 422' ' ' ILE . . . . . 0.873 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -45.78 -26.76 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.56 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.601 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.759 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -77.26 -47.92 18.85 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 177.233 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 424' ' ' GLY . . . . . 0.59 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -57.89 -53.48 45.02 Favored Glycine 0 N--CA 1.447 -0.58 0 N-CA-C 110.058 -1.217 . . . . 0.0 110.058 178.079 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 425' ' ' ILE . . . . . 0.479 HG13 ' HB3' ' B' ' 367' ' ' ASP . 0.7 OUTLIER -59.15 -67.67 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 177.653 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 426' ' ' ARG . . . . . 0.567 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 3.5 tpt180 -35.86 -33.76 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.201 179.213 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 427' ' ' ALA . . . . . 0.68 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -63.33 -58.17 7.98 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.512 178.478 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 428' ' ' ALA . . . . . 1.091 ' CB ' HD11 ' B' ' 374' ' ' LEU . . . -58.25 -53.87 53.35 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 178.476 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 429' ' ' GLU . . . . . 0.542 ' HA ' HD21 ' B' ' 432' ' ' LEU . 1.1 tt0 -49.14 -25.02 1.9 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.365 178.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 430' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 2.4 m-80 -78.34 -36.89 45.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.477 179.114 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 431' ' ' ALA . . . . . 0.497 ' O ' ' CE ' ' B' ' 437' ' ' MET . . . -67.73 -41.77 82.94 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.487 -179.372 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 432' ' ' LEU . . . . . 0.827 ' HA ' HD21 ' B' ' 438' ' ' LEU . 0.6 OUTLIER -81.05 6.88 12.24 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.041 -179.839 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.47 -10.75 59.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.711 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 434' ' ' ASP . . . . . 0.501 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 0.8 OUTLIER -126.25 89.95 3.1 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.609 -0.437 . . . . 0.0 112.009 -178.991 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 435' ' ' LYS . . . . . 0.599 ' HA ' HD12 ' B' ' 438' ' ' LEU . 12.4 ptmt -53.79 -51.36 63.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.2 179.198 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 436' ' ' LYS . . . . . 0.561 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -51.95 -36.23 48.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.144 179.834 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 437' ' ' MET . . . . . 0.501 ' HB3' ' HB3' ' B' ' 434' ' ' ASP . 14.9 tmm? -76.75 -50.47 13.5 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.944 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 438' ' ' LEU . . . . . 0.827 HD21 ' HA ' ' B' ' 432' ' ' LEU . 23.0 mt -53.02 -64.04 0.95 Allowed 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.735 0.779 . . . . 0.0 110.162 178.831 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 439' ' ' ASP . . . . . 0.525 ' O ' ' N ' ' B' ' 442' ' ' ALA . 6.1 t70 -50.55 -50.04 54.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.736 179.11 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 440' ' ' PHE . . . . . 0.43 ' HB3' ' O ' ' B' ' 436' ' ' LYS . 0.1 OUTLIER -43.03 -38.58 2.35 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.777 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 441' ' ' TYR . . . . . 0.526 ' O ' ' CG ' ' B' ' 444' ' ' GLN . 48.1 m-85 -74.33 -31.43 62.44 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.863 179.456 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 442' ' ' ALA . . . . . 0.525 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -59.01 -60.65 3.53 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 177.451 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.9 -37.47 19.84 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 178.104 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 444' ' ' GLN . . . . . 0.662 ' HG3' ' N ' ' B' ' 445' ' ' ARG . 0.0 OUTLIER -62.17 -47.14 85.82 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.384 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 445' ' ' ARG . . . . . 0.693 ' O ' HD11 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -50.06 -35.1 23.77 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.083 179.589 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -86.63 -39.95 15.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.481 -179.542 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . -50.65 -45.45 57.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.912 -179.275 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 448' ' ' ILE . . . . . 0.693 HD11 ' O ' ' B' ' 445' ' ' ARG . 0.9 OUTLIER -42.75 122.3 2.9 Favored Pre-proline 0 C--N 1.324 -0.54 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.683 179.717 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 449' ' ' PRO . . . . . 0.446 ' O ' ' O ' ' B' ' 448' ' ' ILE . 84.7 Cg_exo -46.36 -176.19 0.0 OUTLIER 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.797 2.331 . . . . 0.0 112.698 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.96 170.86 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.619 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 451' ' ' SER . . . . . 0.43 ' O ' ' C ' ' B' ' 452' ' ' GLU . 1.3 m -57.96 96.14 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.576 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 452' ' ' GLU . . . . . 0.43 ' C ' ' O ' ' B' ' 451' ' ' SER . 0.2 OUTLIER 35.79 90.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.971 -179.674 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 13.8 t . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.931 179.954 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 366' ' ' LEU . . . . . 0.815 ' O ' HD23 ' B' ' 366' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.455 -0.202 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.479 ' O ' ' HG2' ' B' ' 371' ' ' LYS . 21.1 t70 26.12 -96.6 0.01 OUTLIER 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.344 -179.3 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.575 ' CE ' ' ND2' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -41.7 -56.24 2.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.553 179.773 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . 0.575 ' ND2' ' CE ' ' B' ' 368' ' ' MET . 3.1 m-80 -62.97 -34.39 77.41 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 1.021 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -62.59 -72.15 0.14 Allowed 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.852 179.176 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.479 ' HG2' ' O ' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -39.15 -38.18 0.46 Allowed 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.648 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.529 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.6 OUTLIER -61.83 -46.47 89.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.234 179.259 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.514 ' HG3' ' HB2' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -60.98 -59.57 5.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.617 179.315 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 0.572 ' N ' HD23 ' B' ' 374' ' ' LEU . 0.7 OUTLIER -46.36 -69.97 0.11 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.109 -0.951 . . . . 0.0 112.025 -179.464 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . 0.523 ' O ' ' N ' ' B' ' 379' ' ' GLY . 1.9 m-85 -72.03 -61.16 1.89 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -177.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.529 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.6 OUTLIER -55.58 -56.88 15.2 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -178.478 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.498 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.2 OUTLIER -72.2 -45.51 60.02 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -178.273 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.78 HG22 HD11 ' B' ' 383' ' ' LEU . 11.3 mm -128.5 39.1 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.317 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' B' ' 375' ' ' TYR . . . -111.21 73.49 0.21 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.415 179.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.862 ' CD1' HD12 ' B' ' 383' ' ' LEU . 23.8 p90 -95.01 -164.64 1.19 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.669 0.271 . . . . 0.0 110.865 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . 0.575 ' O ' ' CE2' ' B' ' 380' ' ' TYR . . . -97.53 124.54 41.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.369 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . 0.57 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 1.5 m 94.33 -10.93 0.12 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.97 179.253 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.862 HD12 ' CD1' ' B' ' 380' ' ' TYR . 5.1 tt -45.49 -39.99 7.9 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.112 0.482 . . . . 0.0 110.532 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 13.9 tpt85 67.33 64.76 0.42 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.929 179.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.561 ' HA ' HG12 ' B' ' 406' ' ' VAL . 0.1 OUTLIER -58.45 157.46 8.82 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.347 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . 0.525 ' CB ' ' O ' ' B' ' 405' ' ' ARG . 0.0 OUTLIER -158.67 72.65 0.6 Allowed 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -178.822 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.578 ' CZ ' ' HB3' ' B' ' 404' ' ' CYS . 5.7 m-85 -86.67 95.56 9.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.849 0.357 . . . . 0.0 110.089 177.135 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . 0.567 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -88.66 136.88 22.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.028 -179.7 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.2 m -97.12 126.43 42.29 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.084 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 0.965 HG23 HG23 ' B' ' 401' ' ' ILE . 28.0 m -132.33 153.21 37.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.5 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.545 ' O ' ' C ' ' B' ' 392' ' ' LYS . 6.6 tptt 87.3 21.87 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.501 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.545 ' C ' ' O ' ' B' ' 391' ' ' LYS . 6.7 mttp -8.72 122.41 0.02 OUTLIER Pre-proline 0 N--CA 1.472 0.647 0 O-C-N 123.839 0.712 . . . . 0.0 111.996 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.514 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 23.9 Cg_exo -62.83 163.04 23.17 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.787 2.325 . . . . 0.0 113.447 -178.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . 0.625 ' OG1' HG22 ' B' ' 396' ' ' VAL . 0.1 OUTLIER -149.65 168.0 24.82 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.337 179.832 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -81.12 7.68 10.49 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.973 0.416 . . . . 0.0 111.159 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . 0.625 HG22 ' OG1' ' B' ' 394' ' ' THR . 5.2 m -129.26 13.59 2.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.425 0.631 . . . . 0.0 109.613 178.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . 0.523 ' OD1' ' CG2' ' B' ' 394' ' ' THR . 10.5 p30 163.51 63.12 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.382 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.528 ' O ' ' C ' ' B' ' 399' ' ' ASN . 75.9 Cg_exo -39.06 -51.35 2.5 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.852 2.368 . . . . 0.0 112.028 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.528 ' C ' ' O ' ' B' ' 398' ' ' PRO . 10.2 m120 -6.75 123.36 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.027 -0.988 . . . . 0.0 112.385 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . 0.498 ' HB3' HG22 ' B' ' 420' ' ' ILE . 0.9 OUTLIER -140.49 137.97 34.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.581 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 0.965 HG23 HG23 ' B' ' 390' ' ' VAL . 0.5 OUTLIER -114.26 141.73 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-O 120.995 0.426 . . . . 0.0 111.18 -179.769 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.602 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.3 OUTLIER -107.87 152.41 9.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.277 -179.178 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 0.567 ' CB ' HG23 ' B' ' 388' ' ' VAL . 0.1 OUTLIER -115.63 98.91 6.97 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.217 178.931 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.655 ' O ' HD22 ' B' ' 412' ' ' LEU . 0.0 OUTLIER -78.43 92.32 4.59 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 179.325 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.594 ' HA ' ' O ' ' B' ' 410' ' ' THR . 5.7 ptp180 -139.14 157.45 45.93 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.498 -179.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.622 HG13 HD21 ' B' ' 412' ' ' LEU . 2.9 m -148.98 158.86 6.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.826 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 73.62 -1.61 43.96 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.82 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 14.6 t0 76.42 7.97 3.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.695 0.283 . . . . 0.0 111.246 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -157.76 17.61 0.34 Allowed Glycine 0 CA--C 1.519 0.338 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.92 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.753 HG21 ' OH ' ' B' ' 441' ' ' TYR . 0.2 OUTLIER -128.74 122.48 30.74 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 116.54 0.17 . . . . 0.0 111.044 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 36.0 t -113.21 103.45 15.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.602 0.239 . . . . 0.0 110.788 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.82 HD13 ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -67.79 -25.22 65.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.959 0.409 . . . . 0.0 110.024 179.546 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . 0.443 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 165.59 -165.36 37.89 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.313 -0.946 . . . . 0.0 112.843 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.473 ' CG2' ' O ' ' B' ' 402' ' ' VAL . 0.2 OUTLIER -150.68 157.41 42.93 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.657 0.265 . . . . 0.0 110.726 -179.766 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.498 ' HA2' ' HG2' ' B' ' 426' ' ' ARG . . . -149.73 152.29 24.26 Favored Glycine 0 C--O 1.226 -0.396 0 C-N-CA 120.044 -1.074 . . . . 0.0 113.226 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . 0.573 ' HB ' HD12 ' B' ' 401' ' ' ILE . 2.7 p -141.4 150.23 19.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.63 0.252 . . . . 0.0 110.898 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.876 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -163.0 161.34 33.81 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.445 -0.883 . . . . 0.0 112.608 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.493 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.0 OUTLIER -74.92 -42.86 56.93 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.807 0.337 . . . . 0.0 111.31 -179.787 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.753 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.7 OUTLIER -98.06 27.32 4.63 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.778 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.721 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 53.44 -44.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 178.903 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.648 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.6 OUTLIER -44.65 -56.8 4.09 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.975 -1.121 . . . . 0.0 107.975 179.867 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.876 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -46.29 -24.96 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.462 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 178.349 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.721 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -79.5 -48.74 13.38 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 177.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . 0.647 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -58.65 -52.82 50.78 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.284 -1.126 . . . . 0.0 110.284 178.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.518 ' N ' HD13 ' B' ' 425' ' ' ILE . 3.3 mm -58.43 -67.22 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 177.638 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.58 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 7.6 tpt180 -36.32 -32.16 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.237 178.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.647 ' HB3' ' O ' ' B' ' 424' ' ' GLY . . . -64.5 -55.13 22.7 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.431 178.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 1.021 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -56.88 -55.7 31.11 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.44 178.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.663 ' HA ' HD21 ' B' ' 432' ' ' LEU . 0.7 OUTLIER -53.5 -21.3 6.05 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.45 179.148 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.516 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.7 OUTLIER -75.65 -41.32 54.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.257 179.03 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.592 ' O ' HD21 ' B' ' 438' ' ' LEU . . . -67.25 -37.72 83.99 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.753 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.803 HD22 ' HA ' ' B' ' 370' ' ' ALA . 0.7 OUTLIER -83.9 9.57 11.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.716 0.293 . . . . 0.0 111.108 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -92.27 -11.72 34.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.245 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.526 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 32.7 m-20 -109.25 71.71 0.78 Allowed 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 120.687 0.279 . . . . 0.0 111.219 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.57 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -45.84 -54.01 8.79 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.433 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.57 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 7.5 mttt -48.19 -40.46 24.2 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.57 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.674 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.4 OUTLIER -77.73 -41.03 39.15 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 178.973 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.592 HD21 ' O ' ' B' ' 431' ' ' ALA . 95.7 mt -56.17 -65.04 0.67 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.966 179.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . 0.494 ' O ' ' N ' ' B' ' 442' ' ' ALA . 21.5 t70 -55.92 -46.42 78.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.267 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.497 ' HB2' ' O ' ' B' ' 436' ' ' LYS . 8.2 t80 -41.97 -45.12 3.71 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.28 -0.873 . . . . 0.0 108.903 179.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.753 ' OH ' HG21 ' B' ' 410' ' ' THR . 16.6 m-30 -67.62 -37.56 82.67 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.487 178.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . 0.494 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -47.61 -61.77 1.77 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 178.285 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.83 -57.34 11.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.643 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.439 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -41.92 -62.88 0.82 Allowed 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.232 0.539 . . . . 0.0 110.36 179.011 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.602 ' HG2' ' CD1' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -43.22 -37.35 2.1 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.819 179.172 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -76.74 -41.05 46.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.919 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.322 -179.656 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 366' ' ' LEU . . . . . 0.496 ' HA ' HD12 ' B' ' 366' ' ' LEU . 2.8 tp . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.878 0.371 . . . . 0.0 111.347 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.54 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -45.67 -71.88 0.07 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.354 179.601 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.702 ' HE1' ' HB3' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -38.58 -35.48 0.19 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.14 -179.129 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . 0.702 ' HB3' ' HE1' ' B' ' 368' ' ' MET . 0.0 OUTLIER -67.71 -39.38 84.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.027 0.441 . . . . 0.0 109.904 179.779 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 0.58 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -62.27 -69.99 0.22 Allowed 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.134 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.543 ' HE3' ' N ' ' B' ' 368' ' ' MET . 0.4 OUTLIER -37.23 -44.93 0.61 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.13 179.428 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.547 ' O ' ' CB ' ' B' ' 376' ' ' SER . 1.4 tmm_? -56.27 -40.68 74.63 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.897 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.517 ' HA ' ' HB2' ' B' ' 377' ' ' LEU . 0.0 OUTLIER -64.26 -48.51 75.47 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.076 0.465 . . . . 0.0 111.273 179.871 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 0.865 HD13 ' OH ' ' B' ' 387' ' ' TYR . 0.3 OUTLIER -59.72 -70.18 0.17 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -178.128 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . 0.553 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 4.6 m-85 -72.51 -34.49 67.65 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -177.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.547 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -83.58 -54.96 4.56 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.561 -179.323 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.537 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.2 OUTLIER -72.68 -35.84 67.77 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.625 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.537 HD13 ' O ' ' B' ' 377' ' ' LEU . 3.9 mm -137.01 36.78 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -178.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.553 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -127.04 90.71 0.36 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.212 -0.994 . . . . 0.0 112.824 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.687 ' CD2' HD12 ' B' ' 383' ' ' LEU . 52.3 p90 -99.74 -160.08 0.78 Allowed 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.397 -0.223 . . . . 0.0 110.397 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . 0.539 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -93.61 123.03 36.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.8 0.333 . . . . 0.0 111.622 -179.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 3.2 m 87.78 -3.66 0.56 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.017 179.03 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.687 HD12 ' CD2' ' B' ' 380' ' ' TYR . 6.2 tt -50.63 -43.67 57.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.807 0.337 . . . . 0.0 111.143 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . 0.55 ' O ' HG12 ' B' ' 406' ' ' VAL . 0.1 OUTLIER 69.84 74.09 0.23 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.674 -179.827 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.656 HD21 ' HE1' ' B' ' 387' ' ' TYR . 9.9 tt -118.68 128.95 55.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.124 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 41.1 p-80 -149.51 146.99 27.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.65 0.738 . . . . 0.0 112.85 -178.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.865 ' OH ' HD13 ' B' ' 374' ' ' LEU . 2.8 m-85 -101.66 141.75 34.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.661 -1.154 . . . . 0.0 110.532 178.558 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . 0.577 HG23 ' HB3' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -124.27 119.52 56.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.204 0.526 . . . . 0.0 110.777 179.317 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.8 m -80.12 122.99 27.49 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.817 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 0.657 HG23 ' CG2' ' B' ' 401' ' ' ILE . 31.5 m -131.86 161.01 42.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.76 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.785 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.2 OUTLIER 94.65 21.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.424 -179.908 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.533 ' O ' ' O ' ' B' ' 391' ' ' LYS . 0.7 OUTLIER 4.24 118.94 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.741 0 O-C-N 124.095 0.872 . . . . 0.0 112.829 179.742 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.488 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 7.0 Cg_exo -68.58 157.03 63.52 Favored 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.615 2.21 . . . . 0.0 113.586 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . 0.432 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 0.6 OUTLIER -137.24 171.77 13.99 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.472 -1.24 . . . . 0.0 111.981 -179.624 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -93.39 18.75 9.23 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-O 121.289 0.566 . . . . 0.0 110.442 179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 34.6 m -135.67 -0.53 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.195 178.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . 0.434 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 1.6 m-20 179.25 56.24 0.06 OUTLIER Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 114.871 -1.059 . . . . 0.0 108.852 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.488 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 73.7 Cg_exo -38.57 -35.75 0.51 Allowed 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 123.282 2.654 . . . . 0.0 112.902 -179.251 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.623 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -30.51 134.3 0.06 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.543 0.687 . . . . 0.0 112.212 -178.208 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . 0.466 ' OG ' ' HG3' ' B' ' 393' ' ' PRO . 45.8 m -143.24 151.68 40.86 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.338 -179.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 0.785 HG22 ' HB2' ' B' ' 391' ' ' LYS . 10.2 tt -109.99 156.12 11.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.962 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.75 ' HB ' ' HB2' ' B' ' 427' ' ' ALA . 0.2 OUTLIER -121.19 152.98 24.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.641 -178.369 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 0.577 ' HB3' HG23 ' B' ' 388' ' ' VAL . 2.8 mt-10 -121.24 122.6 40.29 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.764 178.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.607 ' HB3' ' CZ ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -109.97 108.1 18.23 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 179.163 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.504 ' HA ' ' O ' ' B' ' 410' ' ' THR . 1.2 ptm180 -134.58 -170.02 2.46 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.683 0.754 . . . . 0.0 112.713 -178.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.895 HG23 ' HB ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -158.64 157.75 3.16 Favored 'Isoleucine or valine' 0 C--O 1.243 0.72 0 CA-C-N 114.492 -1.231 . . . . 0.0 112.003 -178.686 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 59.0 -95.08 0.06 OUTLIER Glycine 0 N--CA 1.448 -0.55 0 CA-C-N 114.737 -1.12 . . . . 0.0 111.957 -179.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -167.08 27.1 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.753 0.311 . . . . 0.0 110.366 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 177.08 26.51 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 119.997 -1.097 . . . . 0.0 113.528 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.895 ' HB ' HG23 ' B' ' 406' ' ' VAL . 87.4 m -130.53 109.09 10.42 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 117.168 0.484 . . . . 0.0 110.815 178.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . 0.48 ' HA ' ' HA ' ' B' ' 405' ' ' ARG . 74.1 t -101.85 116.09 44.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.654 0.264 . . . . 0.0 110.521 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.763 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -71.58 -35.38 70.53 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.411 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . 0.494 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 172.38 -176.07 45.42 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.15 -1.024 . . . . 0.0 112.875 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.44 ' O ' ' CG ' ' B' ' 430' ' ' ASN . 0.5 OUTLIER -145.7 155.94 43.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.728 0.299 . . . . 0.0 111.294 -179.369 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.688 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -149.41 135.48 5.36 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.301 -0.952 . . . . 0.0 112.686 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . 0.543 ' HB ' HD12 ' B' ' 401' ' ' ILE . 8.8 p -125.87 152.51 33.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.76 0.314 . . . . 0.0 110.506 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.895 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -159.95 167.24 35.33 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.503 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.535 ' CG ' ' OD1' ' B' ' 419' ' ' ASN . 7.4 ptm180 -71.23 -41.92 69.53 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -179.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.697 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.3 OUTLIER -107.28 34.15 3.64 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.673 0.273 . . . . 0.0 110.802 179.575 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.724 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.7 OUTLIER 55.99 -42.57 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 179.292 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.541 ' N ' HG13 ' B' ' 420' ' ' ILE . 0.0 OUTLIER -45.0 -61.47 1.61 Allowed 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 118.954 0.797 . . . . 0.0 109.721 -179.795 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.895 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -45.31 -21.9 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 177.851 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.724 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -86.19 -50.53 6.91 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.595 178.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . 0.433 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -57.46 -42.52 93.9 Favored Glycine 0 C--N 1.337 0.624 0 C-N-CA 120.083 -1.056 . . . . 0.0 110.998 179.112 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.538 ' CD1' ' N ' ' B' ' 425' ' ' ILE . 0.6 OUTLIER -71.16 -63.38 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.237 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.594 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 12.2 tpt180 -41.37 -31.29 0.23 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.681 178.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.75 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -64.51 -60.35 3.24 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.449 178.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 0.613 ' O ' HD23 ' B' ' 432' ' ' LEU . . . -57.84 -51.9 67.68 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.552 ' O ' ' HB2' ' B' ' 433' ' ' ARG . 79.7 mm-40 -55.33 -21.59 15.61 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.079 178.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.53 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.6 OUTLIER -76.71 -38.81 53.7 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.138 178.881 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.654 ' HB3' HD22 ' B' ' 374' ' ' LEU . . . -62.42 -32.68 73.56 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.328 0.585 . . . . 0.0 109.49 179.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.775 ' HA ' HD21 ' B' ' 438' ' ' LEU . 0.2 OUTLIER -96.99 3.63 51.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.071 178.709 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . 0.552 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 0.0 OUTLIER -89.89 19.72 4.65 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.795 -179.964 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.533 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 15.5 m-20 -136.19 80.67 1.84 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.384 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.576 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.3 OUTLIER -47.18 -57.25 5.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.211 -179.905 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.576 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 2.5 mtmt -49.3 -42.49 41.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.28 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.763 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.5 OUTLIER -70.49 -50.31 39.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.585 179.603 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.775 HD21 ' HA ' ' B' ' 432' ' ' LEU . 85.4 mt -50.78 -59.58 3.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.469 0.652 . . . . 0.0 110.489 179.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -59.09 -42.66 90.99 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.47 178.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.505 ' C ' ' CD1' ' B' ' 440' ' ' PHE . 0.1 OUTLIER -42.81 -48.96 5.8 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 179.368 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.518 ' OH ' HG21 ' B' ' 410' ' ' THR . 55.1 m-85 -62.57 -46.3 88.98 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.56 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . 0.456 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -39.12 -61.69 0.73 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 178.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 1.4 tmtt? -49.47 -49.92 43.47 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 178.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.528 ' O ' ' N ' ' B' ' 447' ' ' ALA . 0.0 OUTLIER -51.04 -59.01 4.62 Favored 'General case' 0 C--N 1.334 -0.085 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 178.878 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.483 ' HD3' ' HB3' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -38.1 -41.67 0.6 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.495 178.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -69.46 -38.16 77.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.896 179.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 447' ' ' ALA . . . . . 0.528 ' N ' ' O ' ' B' ' 444' ' ' GLN . . . . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.696 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 366' ' ' LEU . . . . . 0.451 ' HB3' ' HB2' ' B' ' 369' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.455 -0.193 0 CA-C-O 120.917 0.389 . . . . 0.0 110.906 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.646 ' HA ' HG23 ' B' ' 425' ' ' ILE . 33.9 t0 -61.04 -61.28 2.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.256 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.476 ' HA ' ' CE ' ' B' ' 371' ' ' LYS . 2.1 tmm? -35.51 -53.61 0.67 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.496 179.586 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . 0.451 ' HB2' ' HB3' ' B' ' 366' ' ' LEU . 1.1 m-80 -60.19 -45.49 92.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.28 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 1.027 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -61.36 -71.7 0.14 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.244 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.476 ' CE ' ' HA ' ' B' ' 368' ' ' MET . 0.1 OUTLIER -34.94 -50.75 0.49 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.901 0.381 . . . . 0.0 110.473 -179.836 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.575 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.3 OUTLIER -55.56 -41.59 73.5 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.881 179.669 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.666 ' OE1' HD23 ' B' ' 377' ' ' LEU . 0.3 OUTLIER -66.1 -61.06 2.24 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.141 0.496 . . . . 0.0 110.798 179.601 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 1.072 HD11 ' CB ' ' B' ' 428' ' ' ALA . 0.4 OUTLIER -46.79 -73.24 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.577 0.955 . . . . 0.0 113.577 -178.571 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . 0.47 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.5 m-85 -92.3 -4.93 53.24 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -176.496 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.575 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -113.72 5.28 16.35 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.078 -0.649 . . . . 0.0 110.66 179.122 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.666 HD23 ' OE1' ' B' ' 373' ' ' GLN . 3.7 tp -144.51 -35.85 0.34 Allowed 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.281 179.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.672 HG23 ' CB ' ' B' ' 441' ' ' TYR . 5.5 mm -135.36 38.21 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -179.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.569 ' HA2' HD21 ' B' ' 383' ' ' LEU . . . -149.81 68.18 0.34 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.591 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.712 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 15.1 p90 -74.97 -50.9 15.09 Favored 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 121.071 -0.251 . . . . 0.0 110.696 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . 0.712 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 158.04 -14.75 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 178.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . 0.438 ' HG ' ' HE2' ' B' ' 380' ' ' TYR . 0.5 OUTLIER -124.0 31.69 5.76 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -178.456 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.569 HD21 ' HA2' ' B' ' 379' ' ' GLY . 0.1 OUTLIER -101.0 -8.92 21.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.855 0.359 . . . . 0.0 110.537 178.703 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 57.4 44.05 22.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.145 -0.479 . . . . 0.0 109.95 -179.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.833 ' HA ' HG12 ' B' ' 406' ' ' VAL . 9.8 tt -90.96 125.84 35.9 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . 0.514 ' O ' ' O ' ' B' ' 405' ' ' ARG . 2.3 p-80 -144.96 148.89 34.31 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 -178.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.436 ' CE1' HD21 ' B' ' 385' ' ' LEU . 18.2 m-85 -109.63 148.91 30.49 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.738 -1.119 . . . . 0.0 109.549 177.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . 0.826 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -125.18 125.44 69.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.149 0.5 . . . . 0.0 110.699 179.44 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . 0.522 ' CG2' ' O ' ' B' ' 389' ' ' THR . 0.5 OUTLIER -83.84 117.0 23.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.453 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 0.921 HG23 HG23 ' B' ' 401' ' ' ILE . 33.9 m -130.52 146.74 33.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.156 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.561 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.3 OUTLIER 94.0 19.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.092 -179.812 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.516 ' C ' ' O ' ' B' ' 391' ' ' LYS . 6.4 mttt -6.27 108.32 0.03 OUTLIER Pre-proline 0 N--CA 1.469 0.479 0 O-C-N 123.952 0.782 . . . . 0.0 112.579 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.494 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 5.5 Cg_exo -47.51 157.14 0.9 Allowed 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 122.661 2.241 . . . . 0.0 113.195 -179.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . 0.486 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 1.3 p -150.35 164.95 34.51 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.934 -1.03 . . . . 0.0 111.429 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -78.18 5.93 9.18 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.842 0.353 . . . . 0.0 111.297 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . 0.492 ' O ' ' HB2' ' B' ' 397' ' ' ASP . 4.3 m -132.1 12.84 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.454 0.645 . . . . 0.0 109.352 178.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . 0.492 ' HB2' ' O ' ' B' ' 396' ' ' VAL . 32.1 t70 172.56 56.82 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.153 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.494 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 1.5 Cg_endo -44.41 -61.09 0.63 Allowed 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 123.253 2.635 . . . . 0.0 111.856 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.565 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 1.1 p-10 -22.72 137.04 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.899 -1.046 . . . . 0.0 112.221 -179.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 45.9 t -140.57 154.78 46.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.945 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 0.921 HG23 HG23 ' B' ' 390' ' ' VAL . 0.4 OUTLIER -116.72 142.88 28.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.317 -179.742 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.716 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -107.4 156.35 7.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.666 -179.764 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 0.826 ' CB ' HG23 ' B' ' 388' ' ' VAL . 0.0 OUTLIER -121.6 110.48 16.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.258 179.114 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.802 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 5.7 t -90.5 100.09 12.99 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.855 179.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.514 ' O ' ' O ' ' B' ' 386' ' ' HIS . 6.3 ptm180 -143.25 161.99 36.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.392 0.615 . . . . 0.0 111.889 -178.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.833 HG12 ' HA ' ' B' ' 385' ' ' LEU . 5.3 m -142.13 151.01 18.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.289 179.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 71.32 3.58 53.67 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.02 -1.086 . . . . 0.0 112.081 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 69.28 21.96 6.85 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.737 0.304 . . . . 0.0 110.78 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -146.25 -46.66 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.424 -0.893 . . . . 0.0 113.182 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.49 ' O ' ' HB2' ' B' ' 405' ' ' ARG . 69.0 m -80.41 125.77 30.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.863 0.364 . . . . 0.0 111.669 -179.365 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 52.9 t -107.88 104.15 16.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.908 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.663 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.1 OUTLIER -61.47 -26.07 67.65 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.586 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 160.02 -154.14 25.16 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.466 -0.788 . . . . 0.0 112.3 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.598 ' OG1' HD11 ' B' ' 401' ' ' ILE . 4.6 t -163.25 162.8 25.47 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.108 0.48 . . . . 0.0 111.797 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.55 ' CA ' ' HG2' ' B' ' 426' ' ' ARG . . . -148.04 151.06 23.34 Favored Glycine 0 C--O 1.224 -0.509 0 C-N-CA 120.343 -0.932 . . . . 0.0 113.148 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . 0.674 ' HB ' HD12 ' B' ' 401' ' ' ILE . 5.5 p -142.8 149.6 18.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.728 0.299 . . . . 0.0 110.992 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.94 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -161.3 170.49 37.09 Favored Glycine 0 C--O 1.227 -0.334 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.345 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.519 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 0.0 OUTLIER -81.95 -44.0 17.33 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 116.903 0.351 . . . . 0.0 111.411 179.951 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.743 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.2 OUTLIER -99.99 37.08 1.7 Allowed 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 179.52 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.718 HD12 ' C ' ' B' ' 420' ' ' ILE . 0.6 OUTLIER 48.27 -46.47 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 N-CA-C 115.2 1.556 . . . . 0.0 115.2 178.468 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.706 ' N ' HD12 ' B' ' 420' ' ' ILE . 0.0 OUTLIER -43.3 -56.5 3.48 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -179.51 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.94 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -47.37 -22.26 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.887 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.716 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -83.17 -46.65 12.48 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 177.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -58.94 -51.5 58.82 Favored Glycine 0 C--N 1.334 0.431 0 N-CA-C 110.271 -1.131 . . . . 0.0 110.271 177.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.826 ' N ' HD13 ' B' ' 425' ' ' ILE . 0.9 OUTLIER -61.5 -66.33 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 177.893 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.595 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 7.0 tpt180 -39.02 -32.93 0.1 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.551 179.167 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' B' ' 424' ' ' GLY . . . -62.88 -57.67 10.03 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 178.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 1.072 ' CB ' HD11 ' B' ' 374' ' ' LEU . . . -58.24 -53.78 54.44 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.235 178.317 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.676 ' HA ' HD21 ' B' ' 432' ' ' LEU . 0.5 OUTLIER -54.47 -17.33 3.03 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.936 179.229 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.501 ' OD1' ' N ' ' B' ' 414' ' ' THR . 1.1 m-80 -81.77 -36.75 28.14 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 178.436 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.802 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -68.4 -39.43 81.68 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.349 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.752 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.8 OUTLIER -83.24 10.27 8.81 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.85 0.357 . . . . 0.0 111.013 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -86.95 -8.11 57.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.455 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.439 ' O ' ' HG ' ' B' ' 438' ' ' LEU . 1.1 m-20 -117.8 80.52 1.52 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.655 -179.381 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.569 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 1.9 ptpp? -49.68 -54.32 19.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.242 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.569 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -50.35 -39.01 45.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.098 0.475 . . . . 0.0 110.203 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.663 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.8 OUTLIER -76.52 -40.96 48.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.811 178.927 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.752 HD11 ' HA ' ' B' ' 432' ' ' LEU . 83.4 mt -58.36 -64.54 0.89 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.985 179.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -49.88 -43.35 49.29 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 178.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.486 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -45.32 -42.49 9.91 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.382 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.672 ' CB ' HG23 ' B' ' 378' ' ' ILE . 41.8 m-85 -66.62 -45.78 77.96 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.858 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . 0.435 ' O ' ' HB2' ' B' ' 445' ' ' ARG . . . -41.99 -59.74 1.64 Allowed 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -49.92 -44.59 50.43 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 178.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.518 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -63.12 -12.09 24.86 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.65 179.318 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.571 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -90.41 -36.85 14.35 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.821 -179.746 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -85.74 -37.4 19.39 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.939 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.801 -179.59 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 366' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.457 -0.101 0 CA-C-O 120.796 0.332 . . . . 0.0 111.017 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.544 ' HB3' ' CG1' ' B' ' 425' ' ' ILE . 0.3 OUTLIER -54.67 -68.48 0.18 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 179.44 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.544 ' N ' ' HE2' ' B' ' 371' ' ' LYS . 12.5 tmm? -34.84 -45.59 0.26 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.491 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -62.57 -44.41 96.39 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.872 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 0.755 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -60.36 -69.68 0.21 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 179.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.544 ' HE2' ' N ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -34.13 -51.02 0.42 Allowed 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.509 179.894 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.559 ' O ' ' CB ' ' B' ' 376' ' ' SER . 2.3 tmm_? -56.96 -40.05 75.76 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.783 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.556 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -62.28 -59.03 5.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.121 0.486 . . . . 0.0 110.322 178.846 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 0.759 HD21 HD23 ' B' ' 432' ' ' LEU . 1.7 mt -47.56 -72.65 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.3 -0.864 . . . . 0.0 113.162 -178.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . 0.456 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 24.9 m-85 -74.18 -48.45 29.04 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 -176.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.559 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -63.25 -54.6 34.7 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.652 -178.576 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.563 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.2 OUTLIER -71.78 -43.85 65.0 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -178.331 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.595 HG22 HD13 ' B' ' 383' ' ' LEU . 8.7 mm -114.59 -58.98 3.34 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -177.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.456 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -63.56 66.44 0.04 OUTLIER Glycine 0 CA--C 1.516 0.131 0 C-N-CA 121.14 -0.553 . . . . 0.0 113.117 -179.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.683 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 10.4 p90 -49.01 -35.45 15.43 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 111.567 0.21 . . . . 0.0 111.567 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . 0.683 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 151.48 -10.31 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.586 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . 0.43 ' O ' ' OH ' ' B' ' 380' ' ' TYR . 0.3 OUTLIER -147.43 50.85 1.07 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.916 0.389 . . . . 0.0 110.426 179.715 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.612 HD12 ' HE1' ' B' ' 380' ' ' TYR . 0.8 OUTLIER -106.13 -15.67 14.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.793 -179.961 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . 0.513 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 0.2 OUTLIER 65.89 60.6 0.67 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.111 179.808 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.89 ' HG ' HG12 ' B' ' 406' ' ' VAL . 2.6 tt -105.67 124.62 49.85 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . 0.544 ' O ' ' O ' ' B' ' 405' ' ' ARG . 15.2 p-80 -144.0 148.27 35.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.612 0.72 . . . . 0.0 112.746 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.621 ' OH ' HD13 ' B' ' 374' ' ' LEU . 35.3 m-85 -107.23 144.69 33.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.388 -0.823 . . . . 0.0 111.266 179.077 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . 0.685 HG23 ' HB3' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -125.83 125.92 69.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.762 179.332 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.1 m -88.01 122.43 31.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.209 -179.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 0.912 HG23 HG23 ' B' ' 401' ' ' ILE . 18.2 m -125.1 157.64 33.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.192 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.618 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.2 OUTLIER 89.56 24.07 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.197 179.954 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.52 ' C ' ' O ' ' B' ' 391' ' ' LYS . 8.2 mmpt? 5.44 108.51 0.01 OUTLIER Pre-proline 0 N--CA 1.471 0.605 0 O-C-N 123.938 0.774 . . . . 0.0 112.317 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.486 ' HD2' ' HA ' ' B' ' 392' ' ' LYS . 3.3 Cg_endo -51.31 162.57 1.29 Allowed 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.709 2.273 . . . . 0.0 113.891 -179.119 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 2.5 p -126.58 160.2 31.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.573 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -91.78 20.35 5.68 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-O 121.316 0.579 . . . . 0.0 110.573 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . 0.442 ' O ' ' CB ' ' B' ' 397' ' ' ASP . 23.1 m -138.32 13.52 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.323 177.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . 0.47 ' O ' ' N ' ' B' ' 399' ' ' ASN . 0.7 OUTLIER 159.23 64.28 0.0 OUTLIER Pre-proline 0 N--CA 1.451 -0.392 0 CA-C-N 114.659 -1.155 . . . . 0.0 108.79 -179.238 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.518 ' O ' ' C ' ' B' ' 399' ' ' ASN . 83.4 Cg_exo -37.34 -23.2 0.05 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.322 0 C-N-CA 123.63 2.886 . . . . 0.0 113.676 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.518 ' C ' ' O ' ' B' ' 398' ' ' PRO . 21.1 m120 -20.57 109.4 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.271 0 O-C-N 123.537 0.523 . . . . 0.0 111.537 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 38.1 t -131.78 146.3 52.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.256 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 0.912 HG23 HG23 ' B' ' 390' ' ' VAL . 0.0 OUTLIER -108.29 151.76 10.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.37 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.696 ' HB ' ' HB2' ' B' ' 427' ' ' ALA . 0.2 OUTLIER -119.45 157.93 21.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.781 -178.692 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 0.685 ' HB3' HG23 ' B' ' 388' ' ' VAL . 0.7 OUTLIER -121.34 118.31 29.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.741 178.895 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.546 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -93.09 98.53 11.38 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.222 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.549 ' HA ' ' O ' ' B' ' 410' ' ' THR . 1.0 OUTLIER -133.69 158.2 43.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.348 0.594 . . . . 0.0 112.033 -178.291 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.994 HG13 HD21 ' B' ' 412' ' ' LEU . 2.6 m -138.88 178.65 3.77 Favored 'Isoleucine or valine' 0 C--O 1.238 0.463 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.234 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . 0.457 ' O ' ' HG2' ' B' ' 384' ' ' ARG . . . 64.77 -92.55 0.13 Allowed Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.898 -0.667 . . . . 0.0 112.375 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -163.64 25.94 0.08 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.902 0.382 . . . . 0.0 110.588 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . 0.474 ' HA2' ' NE ' ' B' ' 405' ' ' ARG . . . 163.66 -12.56 0.09 OUTLIER Glycine 0 CA--C 1.522 0.477 0 C-N-CA 120.445 -0.883 . . . . 0.0 113.643 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.549 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 42.4 m -71.8 134.24 46.03 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 117.531 0.665 . . . . 0.0 110.646 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . 0.566 HG13 ' OE1' ' B' ' 403' ' ' GLU . 80.3 t -119.18 114.11 43.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.742 0.306 . . . . 0.0 111.733 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.994 HD21 HG13 ' B' ' 406' ' ' VAL . 0.2 OUTLIER -75.29 -32.45 61.0 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.145 179.024 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . 0.457 ' O ' ' SG ' ' B' ' 404' ' ' CYS . . . 174.4 -168.74 41.58 Favored Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.003 -1.094 . . . . 0.0 113.319 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.504 ' OG1' HD11 ' B' ' 401' ' ' ILE . 0.1 OUTLIER -146.42 158.46 43.89 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.572 -0.314 . . . . 0.0 111.612 -179.161 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.586 ' CA ' ' CG ' ' B' ' 426' ' ' ARG . . . -152.06 138.11 6.3 Favored Glycine 0 C--O 1.225 -0.418 0 C-N-CA 120.451 -0.881 . . . . 0.0 112.833 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . 0.431 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 12.9 p -119.63 150.3 22.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 179.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.797 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -159.73 148.6 17.42 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.267 -0.968 . . . . 0.0 112.262 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.487 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 4.3 ptt85 -67.51 -42.47 82.78 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.788 0.327 . . . . 0.0 111.434 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.806 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.1 OUTLIER -100.3 26.74 6.26 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.959 179.358 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.795 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 55.14 -46.21 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 179.597 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.516 ' O ' ' N ' ' B' ' 424' ' ' GLY . 0.0 OUTLIER -44.53 -58.51 2.95 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 119.913 -0.715 . . . . 0.0 109.239 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.806 HD11 ' H ' ' B' ' 419' ' ' ASN . 0.1 OUTLIER -46.0 -27.92 0.75 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.426 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 177.563 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.795 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -70.97 -51.09 27.71 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 176.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -61.11 -44.2 98.46 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.23 -0.986 . . . . 0.0 111.474 178.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.681 ' N ' HD12 ' B' ' 425' ' ' ILE . 1.4 mp -81.63 -3.45 6.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 120.715 0.293 . . . . 0.0 111.391 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.612 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -96.71 -29.67 13.66 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 176.839 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.696 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -69.95 -42.58 73.04 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.531 -1.285 . . . . 0.0 107.531 176.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 0.755 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -63.13 -56.93 12.6 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' B' ' 425' ' ' ILE . 0.0 OUTLIER -51.41 -22.06 2.73 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.574 178.231 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.47 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.9 OUTLIER -79.47 -39.25 32.65 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.955 179.166 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.766 ' O ' HD21 ' B' ' 438' ' ' LEU . . . -67.25 -30.42 70.32 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.146 -179.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.969 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.2 OUTLIER -95.47 8.24 43.85 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.877 179.772 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.73 -17.23 36.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.077 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.558 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 0.7 OUTLIER -102.85 82.94 2.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.163 -179.12 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.569 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 12.0 ptmt -52.15 -54.69 27.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.924 0.392 . . . . 0.0 110.053 179.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.569 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 1.5 mmpt? -51.73 -42.67 62.48 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.59 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.974 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.2 OUTLIER -71.78 -48.99 42.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.004 0.43 . . . . 0.0 110.145 179.188 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.969 HD11 ' HA ' ' B' ' 432' ' ' LEU . 83.1 mt -52.97 -60.9 2.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.433 0.635 . . . . 0.0 110.019 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . 0.519 ' O ' ' N ' ' B' ' 442' ' ' ALA . 29.1 t70 -56.01 -44.35 78.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.264 -0.88 . . . . 0.0 108.897 178.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.482 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.6 OUTLIER -43.38 -45.01 5.96 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 179.343 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.54 ' HB3' HG23 ' B' ' 378' ' ' ILE . 45.5 m-85 -64.85 -39.42 93.53 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.936 178.368 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . 0.519 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -45.34 -62.54 1.22 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.069 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -45.87 -48.92 15.89 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 178.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.499 ' HB2' ' O ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -50.2 -54.58 19.94 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.037 178.148 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.604 ' HG2' ' CD1' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -41.71 -42.77 2.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.13 179.048 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -72.42 -38.0 68.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.286 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.022 -179.205 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 366' ' ' LEU . . . . . 0.501 ' O ' ' HB2' ' B' ' 369' ' ' ASN . 7.5 mt . . . . . 0 CA--C 1.52 -0.204 0 CA-C-O 120.628 0.251 . . . . 0.0 111.352 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.8 ' HA ' HG23 ' B' ' 425' ' ' ILE . 0.0 OUTLIER -45.75 -71.92 0.07 Allowed 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 178.844 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.603 ' CE ' ' ND2' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -34.37 -44.61 0.2 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.558 179.311 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . 0.603 ' ND2' ' CE ' ' B' ' 368' ' ' MET . 4.5 m-20 -56.33 -52.18 65.51 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.916 0.388 . . . . 0.0 110.529 179.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 0.802 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -61.22 -70.7 0.17 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.67 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.426 ' C ' ' O ' ' B' ' 370' ' ' ALA . 0.3 OUTLIER -36.6 -38.82 0.18 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.134 0.493 . . . . 0.0 110.428 179.924 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.572 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.0 OUTLIER -65.34 -42.32 92.98 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.883 179.799 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.646 ' HG2' HD22 ' B' ' 377' ' ' LEU . 0.1 OUTLIER -59.14 -44.75 92.07 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.583 0.706 . . . . 0.0 110.264 179.136 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -58.68 -69.77 0.18 Allowed 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 -178.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . 0.485 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 5.2 m-30 -96.67 12.03 33.28 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -176.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.759 ' O ' HD12 ' B' ' 377' ' ' LEU . 0.7 OUTLIER -129.81 -1.3 4.78 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.571 179.268 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.759 HD12 ' O ' ' B' ' 376' ' ' SER . 8.8 mp -140.25 -27.52 0.75 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.279 178.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.753 HD13 ' O ' ' B' ' 377' ' ' LEU . 4.5 mm -144.38 39.25 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.169 0 CA-C-O 120.644 0.259 . . . . 0.0 111.536 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.485 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -121.72 97.41 0.61 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.895 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.575 ' CE1' ' HB2' ' B' ' 383' ' ' LEU . 46.4 p90 -124.11 -172.98 2.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.639 0.257 . . . . 0.0 110.634 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . 0.505 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -96.36 83.17 3.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.42 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . 0.505 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 3.2 t 157.7 -34.8 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.103 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.701 ' O ' HD23 ' B' ' 383' ' ' LEU . 1.2 tt -45.84 -42.18 12.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.744 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . 0.497 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 0.9 OUTLIER 62.55 59.58 1.47 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.761 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.778 ' HG ' HG12 ' B' ' 406' ' ' VAL . 7.0 tt -101.32 132.64 46.76 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.869 -179.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . 0.459 ' O ' ' O ' ' B' ' 405' ' ' ARG . 24.9 p-80 -149.78 151.9 34.32 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.3 0.572 . . . . 0.0 112.419 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.661 ' HE1' HD21 ' B' ' 385' ' ' LEU . 7.1 m-85 -107.26 150.01 27.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.009 178.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . 0.791 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -132.42 129.88 59.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.0 179.463 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.3 m -92.31 124.29 36.26 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.661 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 1.097 HG23 HG23 ' B' ' 401' ' ' ILE . 24.2 m -128.3 158.01 40.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.161 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.544 ' HB2' HG22 ' B' ' 401' ' ' ILE . 4.0 tptp 85.82 23.34 0.08 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.67 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.523 ' C ' ' O ' ' B' ' 391' ' ' LYS . 64.2 mmtt -1.29 119.63 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.693 0 O-C-N 124.104 0.877 . . . . 0.0 112.475 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.492 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 17.8 Cg_exo -63.1 159.9 36.72 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.565 2.177 . . . . 0.0 113.077 -179.482 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . 0.487 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 3.1 p -151.79 167.84 26.96 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.621 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -84.67 10.83 10.2 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.161 0.505 . . . . 0.0 110.73 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . 0.449 ' O ' ' CB ' ' B' ' 397' ' ' ASP . 13.8 m -130.42 17.37 2.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 108.841 -0.799 . . . . 0.0 108.841 178.148 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . 0.449 ' CB ' ' O ' ' B' ' 396' ' ' VAL . 0.5 OUTLIER 159.47 58.73 0.0 OUTLIER Pre-proline 0 N--CA 1.451 -0.387 0 CA-C-N 114.578 -1.192 . . . . 0.0 109.184 -179.322 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.492 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 0.9 OUTLIER -42.93 -52.02 5.01 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 123.65 2.9 . . . . 0.0 112.285 -179.769 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.533 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 1.0 OUTLIER -24.54 134.08 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.827 -179.431 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 38.9 t -138.81 151.05 46.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.984 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 1.097 HG23 HG23 ' B' ' 390' ' ' VAL . 0.3 OUTLIER -109.72 142.94 20.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.037 -179.946 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.863 HG21 ' O ' ' B' ' 423' ' ' ALA . 1.6 t -108.26 160.83 7.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.6 -179.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 0.791 ' CB ' HG23 ' B' ' 388' ' ' VAL . 2.4 mt-10 -131.37 116.28 17.35 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.725 179.166 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.584 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -102.11 107.05 18.01 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.358 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.547 ' HA ' ' O ' ' B' ' 410' ' ' THR . 22.9 ptt180 -144.2 165.21 28.5 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.671 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.778 HG12 ' HG ' ' B' ' 385' ' ' LEU . 1.3 m -147.47 160.34 8.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.102 -179.036 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 65.84 2.71 13.09 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.905 -0.664 . . . . 0.0 113.414 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 7.3 t0 72.32 13.79 5.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.928 0.364 . . . . 0.0 111.16 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -157.43 14.63 0.3 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.243 -0.98 . . . . 0.0 113.488 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.547 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 2.5 m -133.83 121.4 21.74 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 117.057 0.429 . . . . 0.0 111.478 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 19.1 t -106.47 102.83 14.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.61 0.243 . . . . 0.0 110.41 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.774 HD13 ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -61.24 -25.33 67.0 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.838 -0.431 . . . . 0.0 109.838 179.422 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . 0.418 ' C ' ' SG ' ' B' ' 404' ' ' CYS . . . 164.61 -163.7 36.39 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.401 -0.904 . . . . 0.0 112.56 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.441 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 3.5 t -160.34 159.75 31.58 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.982 0.42 . . . . 0.0 111.4 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.522 ' CA ' ' HD2' ' B' ' 426' ' ' ARG . . . -152.01 165.0 30.61 Favored Glycine 0 C--O 1.225 -0.443 0 C-N-CA 120.173 -1.013 . . . . 0.0 114.111 -179.144 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . 0.685 HG23 ' HB ' ' B' ' 401' ' ' ILE . 0.8 OUTLIER -152.76 144.91 15.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.396 -0.402 . . . . 0.0 111.412 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 1.021 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -155.98 177.16 33.2 Favored Glycine 0 C--N 1.329 0.187 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.133 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.467 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 9.2 ptm180 -88.23 -43.26 11.72 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.848 0.324 . . . . 0.0 111.72 -179.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.71 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.2 OUTLIER -99.25 34.18 2.23 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 179.719 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.744 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 48.85 -45.04 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 178.509 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.653 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.7 OUTLIER -42.72 -56.04 3.34 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 -179.817 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 1.021 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -47.66 -24.94 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 CA-C-O 121.476 0.655 . . . . 0.0 109.513 178.32 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.863 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -76.48 -49.57 16.22 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.838 -1.074 . . . . 0.0 108.108 176.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . 0.489 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -63.92 -52.57 44.02 Favored Glycine 0 N--CA 1.448 -0.519 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.247 179.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.8 HG23 ' HA ' ' B' ' 367' ' ' ASP . 1.5 mm -64.65 -69.27 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.742 0.306 . . . . 0.0 110.531 179.155 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.544 ' HB3' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -47.37 -25.53 1.04 Allowed 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.278 -178.9 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.737 ' HB2' ' O ' ' B' ' 423' ' ' ALA . . . -60.7 -59.09 5.93 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 107.675 -1.232 . . . . 0.0 107.675 176.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 0.859 ' O ' HD13 ' B' ' 432' ' ' LEU . . . -52.92 -48.73 67.03 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 177.23 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.66 ' HA ' HD21 ' B' ' 432' ' ' LEU . 1.9 tt0 -52.94 -17.84 1.64 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.732 178.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 10.4 m120 -85.25 -35.78 21.35 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.047 178.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.509 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -67.32 -36.31 81.2 Favored 'General case' 0 N--CA 1.461 0.116 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.733 -179.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.878 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -94.01 12.2 27.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.805 179.58 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -87.04 -12.61 46.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.25 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -112.47 93.55 4.49 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.881 0.372 . . . . 0.0 111.4 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.556 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 8.9 ptmm? -57.37 -50.78 71.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.38 179.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.556 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -51.73 -45.39 63.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.637 179.896 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.608 ' SD ' HD12 ' B' ' 412' ' ' LEU . 1.2 ttp -72.81 -46.69 51.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.113 0.482 . . . . 0.0 110.238 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.878 HD11 ' HA ' ' B' ' 432' ' ' LEU . 62.1 mt -53.98 -60.44 3.33 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.672 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . 0.415 ' O ' ' N ' ' B' ' 442' ' ' ALA . 22.4 t70 -54.43 -44.3 72.32 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.515 179.19 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.493 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -43.49 -45.07 6.29 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.609 -0.885 . . . . 0.0 108.609 179.424 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.423 ' O ' ' C ' ' B' ' 442' ' ' ALA . 51.7 m-85 -64.65 -43.17 94.5 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.331 179.039 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . 0.456 ' O ' ' N ' ' B' ' 445' ' ' ARG . . . -42.32 -61.79 1.11 Allowed 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 178.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -48.86 -45.7 41.26 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.416 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -65.19 -7.72 14.07 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.942 178.898 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.549 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -89.54 -44.18 10.29 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.374 179.441 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -82.37 -33.03 28.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.571 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.31 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.921 179.961 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 366' ' ' LEU . . . . . 0.834 HD23 ' ND2' ' B' ' 369' ' ' ASN . 14.9 tp . . . . . 0 C--O 1.233 0.19 0 CA-C-O 120.994 0.426 . . . . 0.0 111.219 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.518 ' CG ' HD12 ' B' ' 425' ' ' ILE . 21.5 t0 -58.29 -64.92 0.75 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.179 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.498 ' HA ' ' CE ' ' B' ' 371' ' ' LYS . 1.5 ttp -35.82 -44.05 0.33 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.615 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . 0.834 ' ND2' HD23 ' B' ' 366' ' ' LEU . 2.7 m-80 -60.99 -47.91 84.28 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.571 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 1.076 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -58.94 -70.59 0.14 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.626 179.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.498 ' CE ' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -36.22 -49.48 0.68 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.814 179.924 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.557 ' O ' ' CB ' ' B' ' 376' ' ' SER . 1.6 tmm_? -55.42 -38.44 68.98 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.508 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.547 ' O ' ' HB2' ' B' ' 377' ' ' LEU . 0.0 OUTLIER -65.58 -62.61 1.42 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.598 0.713 . . . . 0.0 110.425 179.175 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 0.67 HD13 ' OH ' ' B' ' 387' ' ' TYR . 1.0 OUTLIER -43.2 -70.77 0.1 Allowed 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -178.959 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -93.04 -20.83 20.16 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 -176.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.557 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.6 OUTLIER -94.45 1.6 55.76 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 119.91 -0.716 . . . . 0.0 111.1 -179.525 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.547 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 0.3 OUTLIER -134.68 -37.83 0.83 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.663 178.218 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.488 HG23 ' CB ' ' B' ' 441' ' ' TYR . 0.8 OUTLIER -127.76 -149.33 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.898 179.284 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.485 ' H ' HG22 ' B' ' 378' ' ' ILE . . . 28.74 74.24 0.03 OUTLIER Glycine 0 C--N 1.332 0.338 0 C-N-CA 121.35 -0.452 . . . . 0.0 113.506 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.68 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 13.7 p90 -100.12 -50.76 3.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.697 0.248 . . . . 0.0 111.176 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . 0.68 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 158.98 66.03 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.957 0.408 . . . . 0.0 111.079 179.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . 0.57 ' HB2' ' CZ ' ' B' ' 380' ' ' TYR . 7.0 t -171.91 -72.18 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.795 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.465 HD21 ' HA2' ' B' ' 379' ' ' GLY . 2.6 pt? -49.22 -26.41 2.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.248 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . 0.475 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 7.1 tpt180 68.56 70.87 0.29 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.101 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.695 ' HG ' HG12 ' B' ' 406' ' ' VAL . 10.5 tt -89.18 121.98 32.02 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 179.118 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . 0.514 ' O ' ' O ' ' B' ' 405' ' ' ARG . 2.5 p-80 -141.57 145.87 35.61 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.401 0.62 . . . . 0.0 112.584 -179.025 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.67 ' OH ' HD13 ' B' ' 374' ' ' LEU . 28.7 m-85 -99.43 151.85 20.64 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.363 178.156 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . 1.006 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -129.82 120.35 49.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.345 179.114 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.9 m -87.06 119.11 26.93 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.257 -179.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 0.998 HG23 HG23 ' B' ' 401' ' ' ILE . 34.0 m -126.75 151.94 34.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.132 179.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.582 ' CB ' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 73.81 111.72 0.07 Allowed 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -178.834 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.425 ' HA ' ' HD3' ' B' ' 393' ' ' PRO . 21.1 mttt -96.54 133.13 25.09 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 120.93 0.395 . . . . 0.0 111.281 -179.246 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.493 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 24.3 Cg_exo -62.22 166.04 13.64 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.631 2.22 . . . . 0.0 112.393 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . 0.487 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 64.4 p -150.64 173.88 13.63 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.459 179.178 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -85.92 15.02 5.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.192 0.52 . . . . 0.0 110.58 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 22.8 m -146.79 16.73 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.272 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 167.86 68.29 0.01 OUTLIER Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.111 -179.391 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.532 ' HB2' ' O ' ' B' ' 418' ' ' ARG . 14.2 Cg_endo -55.4 -42.86 64.04 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 123.237 2.625 . . . . 0.0 112.311 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.548 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 6.0 m-20 -20.07 124.17 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.671 -179.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -133.79 141.57 47.53 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.361 178.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 0.998 HG23 HG23 ' B' ' 390' ' ' VAL . 0.2 OUTLIER -114.05 138.46 43.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-O 121.269 0.557 . . . . 0.0 111.376 -179.058 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.756 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.7 OUTLIER -105.11 166.7 3.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.433 -179.879 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 1.006 ' CB ' HG23 ' B' ' 388' ' ' VAL . 1.0 OUTLIER -133.8 112.59 11.46 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.045 0.45 . . . . 0.0 110.472 179.326 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.423 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -94.51 108.61 20.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.506 179.186 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.562 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.2 OUTLIER -150.3 169.28 21.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.151 0.501 . . . . 0.0 111.413 -179.439 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.695 HG12 ' HG ' ' B' ' 385' ' ' LEU . 1.2 m -144.59 145.21 21.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.775 -179.57 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 67.43 2.44 20.63 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.907 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . 0.499 ' HA ' ' HD3' ' B' ' 405' ' ' ARG . 16.5 t70 71.14 13.69 6.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.726 0.298 . . . . 0.0 111.066 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -137.11 -6.62 1.65 Allowed Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.395 -0.907 . . . . 0.0 113.6 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.562 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 95.3 m -127.03 119.71 27.28 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 117.15 0.475 . . . . 0.0 111.547 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . 0.514 ' HA ' ' HB2' ' B' ' 405' ' ' ARG . 41.5 t -102.89 97.09 5.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-O 120.752 0.31 . . . . 0.0 110.75 179.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.757 HD13 ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -56.32 -22.48 30.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.696 -179.971 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 164.71 -165.66 37.6 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.405 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.683 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.0 OUTLIER -152.12 152.67 32.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.775 0.321 . . . . 0.0 110.732 -179.916 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.542 ' HA2' ' HG2' ' B' ' 426' ' ' ARG . . . -133.58 149.72 19.74 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 119.75 -1.214 . . . . 0.0 113.379 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . 0.566 ' O ' HG13 ' B' ' 416' ' ' VAL . 3.8 p -148.26 118.88 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.776 0.322 . . . . 0.0 110.544 179.293 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.654 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -133.29 164.66 24.22 Favored Glycine 0 C--O 1.226 -0.347 0 C-N-CA 120.842 -0.694 . . . . 0.0 111.395 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.532 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.5 OUTLIER -79.88 -48.1 14.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 117.465 0.632 . . . . 0.0 111.316 -179.953 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.909 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.2 OUTLIER -74.41 -23.62 58.98 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.758 -0.201 . . . . 0.0 111.096 -179.651 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.909 HG23 ' O ' ' B' ' 419' ' ' ASN . 0.9 OUTLIER 102.87 -43.61 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 C-N-CA 124.299 1.04 . . . . 0.0 109.946 -178.374 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.628 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -49.92 -54.59 18.76 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.032 -1.47 . . . . 0.0 107.032 178.605 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.706 HD11 ' H ' ' B' ' 419' ' ' ASN . 0.1 OUTLIER -53.21 -14.48 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.515 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.89 177.935 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.762 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -84.06 -49.14 9.19 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 107.22 -1.4 . . . . 0.0 107.22 176.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . 0.616 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -60.88 -54.17 39.15 Favored Glycine 0 C--N 1.336 0.534 0 N-CA-C 109.883 -1.287 . . . . 0.0 109.883 177.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.518 HD12 ' CG ' ' B' ' 367' ' ' ASP . 8.9 mm -53.96 -68.28 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 177.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.593 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 2.6 tpt180 -39.93 -28.56 0.05 Allowed 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.101 179.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.616 ' HB3' ' O ' ' B' ' 424' ' ' GLY . . . -64.68 -55.1 22.22 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 177.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 1.076 ' CB ' ' HB1' ' B' ' 370' ' ' ALA . . . -59.84 -55.01 39.47 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.07 -11.92 0.53 Allowed 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.794 179.285 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.502 ' ND2' ' O ' ' B' ' 426' ' ' ARG . 1.4 m-80 -92.09 -32.04 15.31 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 177.668 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.439 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -71.93 -44.9 62.88 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.027 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.856 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.4 OUTLIER -85.1 11.1 10.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.015 -179.948 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . 0.514 ' HG2' ' O ' ' B' ' 433' ' ' ARG . 0.0 OUTLIER -80.27 -0.1 35.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.372 179.816 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.469 ' O ' ' HG ' ' B' ' 438' ' ' LEU . 31.3 t0 -130.09 93.17 3.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.747 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.58 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -58.24 -39.7 79.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.867 -179.832 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.58 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 9.8 mtpt -57.27 -41.64 80.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.767 0.318 . . . . 0.0 110.414 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.648 ' SD ' HD12 ' B' ' 412' ' ' LEU . 33.7 ttp -74.67 -48.43 26.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.169 0.509 . . . . 0.0 109.811 179.059 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.856 HD11 ' HA ' ' B' ' 432' ' ' LEU . 94.1 mt -53.94 -64.42 0.83 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.192 178.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -51.95 -45.25 64.29 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.245 -0.888 . . . . 0.0 109.93 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.574 ' CE1' ' HG3' ' B' ' 444' ' ' GLN . 0.1 OUTLIER -45.2 -38.59 5.48 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 179.561 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.548 ' CE1' ' CE2' ' B' ' 440' ' ' PHE . 25.6 m-85 -74.44 -39.64 62.44 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.061 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -52.15 -60.52 3.11 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 178.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 8.7 tttp -50.7 -44.4 57.98 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.206 -0.665 . . . . 0.0 109.206 178.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.574 ' HG3' ' CE1' ' B' ' 440' ' ' PHE . 0.0 OUTLIER -55.18 -50.75 68.57 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.028 178.787 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.615 ' HD2' ' CD1' ' B' ' 380' ' ' TYR . 7.8 mmp_? -51.69 -36.65 47.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.793 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -75.19 -41.14 58.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.956 0.408 . . . . 0.0 110.442 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.288 179.905 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 366' ' ' LEU . . . . . 0.463 ' HB3' ' HB2' ' B' ' 369' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.181 0 CA-C-O 120.886 0.374 . . . . 0.0 111.223 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.523 ' CB ' HG13 ' B' ' 425' ' ' ILE . 0.0 OUTLIER -55.42 -71.08 0.09 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.601 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.434 ' HE3' ' HB3' ' B' ' 368' ' ' MET . 3.3 tmm? -35.72 -43.79 0.3 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.999 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . 0.463 ' HB2' ' HB3' ' B' ' 366' ' ' LEU . 87.1 m-20 -65.31 -42.9 92.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.896 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 0.806 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -62.76 -71.94 0.15 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.448 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.462 ' HD3' ' O ' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -35.82 -49.45 0.61 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.968 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.572 ' O ' ' CB ' ' B' ' 376' ' ' SER . 3.5 tmm_? -58.39 -37.03 74.45 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.924 0.393 . . . . 0.0 110.71 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.548 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -62.34 -48.61 79.05 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.219 0.533 . . . . 0.0 110.973 179.259 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 0.925 HD13 ' OH ' ' B' ' 387' ' ' TYR . 0.4 OUTLIER -62.42 -69.06 0.28 Allowed 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -178.127 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -70.83 -40.2 72.56 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -177.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.572 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.5 OUTLIER -71.9 -51.63 21.24 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.227 0.455 . . . . 0.0 112.227 -178.642 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.624 ' O ' HD13 ' B' ' 378' ' ' ILE . 2.3 mm? -89.32 -23.25 22.31 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 114.733 1.383 . . . . 0.0 114.733 -176.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.624 HD13 ' O ' ' B' ' 377' ' ' LEU . 20.8 mm -127.82 -74.77 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 119.219 0.918 . . . . 0.0 113.429 -178.018 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.562 ' N ' ' O ' ' B' ' 374' ' ' LEU . . . -51.61 80.43 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.176 0 CA-C-N 116.188 -0.46 . . . . 0.0 113.433 -178.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.637 ' CE1' ' O ' ' B' ' 382' ' ' SER . 14.5 p90 -102.05 173.18 6.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.757 0.313 . . . . 0.0 111.117 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . 0.442 ' C ' ' O ' ' B' ' 380' ' ' TYR . . . -28.07 -43.03 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.193 -179.281 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . 0.637 ' O ' ' CE1' ' B' ' 380' ' ' TYR . 0.5 OUTLIER -114.39 132.34 56.26 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.839 -179.945 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.971 HD11 ' HB2' ' B' ' 385' ' ' LEU . 0.1 OUTLIER 151.31 -49.74 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.936 0.398 . . . . 0.0 110.479 -179.871 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . 0.743 ' N ' HD13 ' B' ' 383' ' ' LEU . 0.0 OUTLIER 69.88 73.75 0.23 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.064 178.708 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.971 ' HB2' HD11 ' B' ' 383' ' ' LEU . 6.0 tt -102.71 128.8 49.27 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 179.107 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . 0.478 ' O ' ' O ' ' B' ' 405' ' ' ARG . 14.9 p-80 -141.32 144.96 34.88 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.48 0.657 . . . . 0.0 112.761 -179.038 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.925 ' OH ' HD13 ' B' ' 374' ' ' LEU . 27.4 m-85 -103.06 145.93 29.15 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.748 178.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . 0.739 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -129.08 122.23 55.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.128 179.211 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.7 m -85.5 122.52 29.75 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.555 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 0.574 HG23 ' CG2' ' B' ' 401' ' ' ILE . 35.7 m -130.25 154.28 40.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.549 -179.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.555 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 9.0 tptt 95.07 23.01 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.326 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.532 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER 3.62 114.11 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.696 0 O-C-N 123.979 0.799 . . . . 0.0 112.192 179.931 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.47 ' HG3' ' HB2' ' B' ' 400' ' ' SER . 34.5 Cg_exo -55.2 163.64 4.41 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.525 2.15 . . . . 0.0 113.226 -179.17 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . 0.473 ' CG2' ' OD1' ' B' ' 397' ' ' ASP . 0.1 OUTLIER -131.33 177.22 7.64 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.706 -1.133 . . . . 0.0 111.738 -179.288 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -102.08 18.0 21.87 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.565 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . 0.499 ' O ' ' HB3' ' B' ' 397' ' ' ASP . 10.1 m -137.4 6.57 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.984 178.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . 0.499 ' HB3' ' O ' ' B' ' 396' ' ' VAL . 17.8 p-10 172.79 54.17 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.384 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.464 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 93.1 Cg_exo -33.34 -29.18 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.613 2.875 . . . . 0.0 113.566 -179.161 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.559 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 1.1 p-10 -31.65 125.41 0.24 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.189 0.519 . . . . 0.0 111.854 -178.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . 0.47 ' HB2' ' HG3' ' B' ' 393' ' ' PRO . 29.1 t -133.92 157.01 47.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.914 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 0.574 ' CG2' HG23 ' B' ' 390' ' ' VAL . 4.6 tt -114.85 151.58 16.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.14 0.495 . . . . 0.0 111.037 -179.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.681 ' O ' HG22 ' B' ' 414' ' ' THR . 0.4 OUTLIER -116.14 158.59 16.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.14 -178.971 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 0.739 ' CB ' HG23 ' B' ' 388' ' ' VAL . 3.6 mm-40 -122.79 118.37 27.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.884 179.012 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.666 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 8.9 t -96.77 100.04 11.6 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 179.056 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.651 ' HA ' ' O ' ' B' ' 410' ' ' THR . 13.1 ttp180 -140.35 162.73 34.59 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 121.033 0.444 . . . . 0.0 111.53 -179.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.654 HG12 ' HG ' ' B' ' 385' ' ' LEU . 2.0 m -146.5 -178.54 0.71 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.44 -179.328 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 58.86 -101.48 0.22 Allowed Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.914 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -156.95 18.37 0.31 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.874 0.368 . . . . 0.0 110.965 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 165.03 37.35 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.937 -0.649 . . . . 0.0 111.942 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.651 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 17.4 m -122.96 114.73 20.82 Favored 'General case' 0 C--O 1.217 -0.644 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . 0.485 HG22 ' HB2' ' B' ' 405' ' ' ARG . 47.1 t -107.33 107.79 23.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.581 0.229 . . . . 0.0 111.047 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.653 HD21 HG13 ' B' ' 406' ' ' VAL . 0.6 OUTLIER -66.91 -27.87 67.85 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 179.324 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . 0.53 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 167.26 -168.19 40.3 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.211 -0.995 . . . . 0.0 113.004 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.681 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.0 OUTLIER -145.58 155.97 43.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.697 0.284 . . . . 0.0 111.211 -179.364 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.545 ' O ' ' CG1' ' B' ' 401' ' ' ILE . . . -148.3 151.89 24.03 Favored Glycine 0 C--O 1.223 -0.564 0 C-N-CA 120.227 -0.987 . . . . 0.0 113.22 -179.477 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . 0.412 ' HB ' HG13 ' B' ' 401' ' ' ILE . 3.5 p -139.12 148.86 23.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.731 0.301 . . . . 0.0 110.978 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.825 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -160.53 152.59 23.35 Favored Glycine 0 C--O 1.228 -0.24 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.16 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.422 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 0.0 OUTLIER -68.81 -44.5 73.4 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.378 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.798 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.3 OUTLIER -98.05 32.08 2.52 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.185 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.724 HD12 ' C ' ' B' ' 420' ' ' ILE . 0.4 OUTLIER 51.55 -47.43 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 178.59 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.635 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -44.91 -54.79 6.09 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -179.577 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.825 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -50.39 -19.34 0.71 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.527 0 N-CA-C 109.9 -0.408 . . . . 0.0 109.9 178.486 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.663 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -83.23 -48.37 10.55 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 177.124 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . 0.711 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -59.78 -52.36 53.42 Favored Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 177.666 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.523 HG13 ' CB ' ' B' ' 367' ' ' ASP . 0.5 OUTLIER -57.61 -67.17 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 177.329 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.615 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 10.8 tpt180 -39.81 -30.19 0.08 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.096 178.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.711 ' HB3' ' O ' ' B' ' 424' ' ' GLY . . . -60.71 -61.42 2.6 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 0.806 ' CB ' ' HB1' ' B' ' 370' ' ' ALA . . . -53.23 -49.84 66.0 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 177.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.589 ' HA ' HD21 ' B' ' 432' ' ' LEU . 1.4 tt0 -47.51 -24.54 0.87 Allowed 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.431 178.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.53 ' HB3' ' HA3' ' B' ' 413' ' ' GLY . 14.2 m120 -81.71 -34.63 30.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.65 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.666 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -69.84 -42.28 73.79 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.966 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -83.66 9.62 11.2 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.889 -0.324 . . . . 0.0 111.408 -179.507 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . 0.453 ' HD2' ' HA ' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -88.68 -9.75 50.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.163 -179.587 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.5 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 76.7 m-20 -108.91 83.51 1.77 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.239 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.543 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 4.6 ptmm? -50.77 -53.38 32.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.027 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.543 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 10.0 mtpp -52.48 -43.98 65.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.736 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.5 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 14.3 tmm? -70.08 -50.52 40.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.964 0.412 . . . . 0.0 110.252 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.966 HD11 ' HA ' ' B' ' 432' ' ' LEU . 85.6 mt -52.77 -61.98 1.94 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.398 179.326 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -56.42 -44.13 80.08 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.032 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.45 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -42.29 -44.73 3.95 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.908 179.641 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.46 ' O ' ' HG2' ' B' ' 445' ' ' ARG . 49.9 m-85 -67.94 -44.49 76.71 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.62 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . 0.409 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -44.5 -60.54 1.92 Allowed 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 178.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 11.2 ttmt -47.76 -38.93 16.57 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.652 -0.703 . . . . 0.0 109.219 178.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.635 ' HG3' ' N ' ' B' ' 445' ' ' ARG . 0.0 OUTLIER -61.3 -51.32 69.38 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 178.512 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.635 ' N ' ' HG3' ' B' ' 444' ' ' GLN . 0.3 OUTLIER -44.11 -43.95 7.26 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.993 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -80.59 -36.21 33.13 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.189 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.295 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.942 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 366' ' ' LEU . . . . . 0.491 HD12 ' HA ' ' B' ' 366' ' ' LEU . 6.1 tp . . . . . 0 CA--C 1.523 -0.078 0 CA-C-O 121.369 0.604 . . . . 0.0 110.79 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.664 ' HB3' HD12 ' B' ' 425' ' ' ILE . 0.2 OUTLIER -44.75 -75.14 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.99 179.396 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.42 ' C ' ' O ' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -36.15 -44.2 0.38 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.666 179.779 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . 0.472 ' HB2' ' HG ' ' B' ' 366' ' ' LEU . 7.7 m120 -66.49 -38.36 87.11 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.921 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 0.927 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -61.31 -70.45 0.19 Allowed 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.426 ' C ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -39.07 -42.17 0.88 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.061 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.559 ' O ' ' CB ' ' B' ' 376' ' ' SER . 3.0 tmt_? -53.49 -43.28 68.1 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.73 179.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.546 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -64.43 -60.93 2.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.485 179.212 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 0.658 ' N ' HD23 ' B' ' 374' ' ' LEU . 0.7 OUTLIER -45.8 -74.4 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 -178.474 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -95.56 -4.7 44.21 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -176.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.559 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -108.84 1.15 20.7 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.044 -0.662 . . . . 0.0 110.337 179.017 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.723 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.2 OUTLIER -133.88 -40.16 0.86 Allowed 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 178.215 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.723 HD13 ' O ' ' B' ' 377' ' ' LEU . 2.1 mm -129.37 -144.88 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.609 179.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.479 ' H ' HG22 ' B' ' 378' ' ' ILE . . . 40.65 66.61 0.83 Allowed Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.993 -0.622 . . . . 0.0 113.701 179.026 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.676 ' O ' ' HB3' ' B' ' 381' ' ' ALA . 30.9 p90 -77.12 -4.03 42.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.802 0.301 . . . . 0.0 110.569 179.04 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . 0.676 ' HB3' ' O ' ' B' ' 380' ' ' TYR . . . 95.15 -38.53 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 178.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . 0.443 ' HB3' ' CD2' ' B' ' 380' ' ' TYR . 11.1 t -86.59 24.9 1.33 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.172 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.646 HD12 ' CE1' ' B' ' 441' ' ' TYR . 0.4 OUTLIER -114.31 -5.8 12.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.699 0.285 . . . . 0.0 111.064 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . 0.501 ' O ' HG12 ' B' ' 406' ' ' VAL . 14.5 tpp180 63.68 59.14 1.2 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.994 0.426 . . . . 0.0 110.693 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.613 ' HA ' HG12 ' B' ' 406' ' ' VAL . 7.8 tt -114.43 133.11 55.97 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.907 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . 0.595 ' N ' HD23 ' B' ' 385' ' ' LEU . 6.2 p-80 -158.85 160.73 36.51 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.631 0.729 . . . . 0.0 112.785 -179.078 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.615 ' CE2' ' HB1' ' B' ' 427' ' ' ALA . 8.0 m-85 -108.09 145.72 33.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.624 -1.171 . . . . 0.0 110.511 178.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . 0.461 HG23 ' HB2' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -127.86 125.56 65.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.536 179.108 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.6 m -86.14 123.87 31.91 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.499 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 1.009 HG23 HG23 ' B' ' 401' ' ' ILE . 19.6 m -129.89 156.97 42.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.01 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.84 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 86.49 19.9 0.08 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.036 179.868 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.509 ' C ' ' O ' ' B' ' 391' ' ' LYS . 1.3 mmmt -2.76 122.66 0.0 OUTLIER Pre-proline 0 N--CA 1.471 0.616 0 O-C-N 124.194 0.934 . . . . 0.0 112.551 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.497 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 12.4 Cg_exo -66.24 157.48 59.76 Favored 'Trans proline' 0 N--CA 1.464 -0.24 0 C-N-CA 122.695 2.263 . . . . 0.0 113.282 -179.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . 0.463 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 0.3 OUTLIER -148.64 166.34 28.63 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.798 -1.092 . . . . 0.0 111.472 -179.764 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -82.69 10.13 8.16 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-O 121.089 0.471 . . . . 0.0 110.812 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . 0.424 HG22 ' OG1' ' B' ' 394' ' ' THR . 27.2 m -132.67 15.04 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 165.73 57.46 0.0 OUTLIER Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 114.581 -1.19 . . . . 0.0 109.335 -179.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.497 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 1.0 OUTLIER -42.95 -54.64 3.24 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 123.483 2.789 . . . . 0.0 111.715 179.981 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.531 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 6.7 m120 -19.54 130.51 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.837 -1.074 . . . . 0.0 112.002 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -140.25 150.49 44.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.898 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 1.009 HG23 HG23 ' B' ' 390' ' ' VAL . 0.5 OUTLIER -115.44 143.98 24.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.985 -179.714 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.636 HG23 ' HB1' ' B' ' 423' ' ' ALA . 1.5 t -108.65 159.62 7.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.949 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 0.461 ' HB2' HG23 ' B' ' 388' ' ' VAL . 0.9 OUTLIER -134.03 123.35 24.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.442 179.568 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.533 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.1 OUTLIER -111.08 113.04 25.27 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 179.27 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.592 ' HA ' ' O ' ' B' ' 410' ' ' THR . 3.1 ptt180 -141.26 171.73 13.67 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 123.389 0.431 . . . . 0.0 111.675 -179.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.668 HG23 ' HB ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -139.32 166.7 21.18 Favored 'Isoleucine or valine' 0 C--O 1.239 0.536 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.383 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . 0.592 ' O ' ' CB ' ' B' ' 408' ' ' ASP . . . -45.26 103.3 0.05 OUTLIER Glycine 0 C--N 1.338 0.686 0 CA-C-N 114.879 -1.055 . . . . 0.0 113.335 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . 0.592 ' CB ' ' O ' ' B' ' 407' ' ' GLY . 3.8 t70 137.21 -9.14 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 123.796 0.838 . . . . 0.0 109.745 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 88.81 19.04 53.14 Favored Glycine 0 N--CA 1.442 -0.904 0 N-CA-C 110.876 -0.89 . . . . 0.0 110.876 -179.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.668 ' HB ' HG23 ' B' ' 406' ' ' VAL . 34.7 m -82.49 125.49 31.16 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 26.8 t -103.09 110.79 30.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 120.678 0.275 . . . . 0.0 110.301 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.843 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.3 OUTLIER -64.07 -28.91 70.11 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.286 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 167.58 -169.03 40.95 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.162 -1.018 . . . . 0.0 112.749 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.529 ' OG1' HD11 ' B' ' 401' ' ' ILE . 3.5 t -156.0 148.76 24.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.909 0.385 . . . . 0.0 110.949 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.539 ' HA2' ' HG2' ' B' ' 426' ' ' ARG . . . -131.6 162.42 23.75 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.261 -0.971 . . . . 0.0 113.279 -179.569 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . 0.413 ' HB ' HD12 ' B' ' 401' ' ' ILE . 3.5 p -142.57 150.4 18.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.689 -0.256 . . . . 0.0 110.731 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.89 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -172.57 150.0 12.18 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.165 -1.017 . . . . 0.0 113.008 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.418 ' HA ' ' CG ' ' B' ' 399' ' ' ASN . 0.0 OUTLIER -69.73 -43.28 72.64 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.822 0.344 . . . . 0.0 111.894 -179.701 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.728 ' H ' HD11 ' B' ' 422' ' ' ILE . 6.0 t30 -97.06 29.19 3.21 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.69 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 51.38 -45.43 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 178.401 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.647 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -43.95 -54.36 5.43 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 -179.92 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.89 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -48.07 -21.04 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.057 178.551 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.69 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -83.57 -47.71 11.02 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 177.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . 0.686 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -59.63 -52.23 54.28 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 110.136 -1.186 . . . . 0.0 110.136 177.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.664 HD12 ' HB3' ' B' ' 367' ' ' ASP . 4.8 mm -58.46 -67.15 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 177.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.579 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 24.2 tpt180 -38.01 -31.31 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.186 178.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.686 ' HB3' ' O ' ' B' ' 424' ' ' GLY . . . -62.93 -57.59 10.27 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 178.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 0.927 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -55.76 -52.39 64.12 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.67 178.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.48 ' OE2' ' HB2' ' B' ' 370' ' ' ALA . 0.7 OUTLIER -56.63 -18.25 11.43 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.706 179.369 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.512 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.9 OUTLIER -79.85 -40.8 27.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.407 178.862 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.487 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -67.46 -35.03 78.39 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.376 -179.317 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.7 ' HA ' HD21 ' B' ' 438' ' ' LEU . 0.2 OUTLIER -86.98 10.96 14.77 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.682 179.786 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -85.0 -9.07 58.42 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.079 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.544 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 62.7 m-20 -115.65 80.01 1.38 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.021 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.563 ' HA ' HD12 ' B' ' 438' ' ' LEU . 7.7 ptpt -48.92 -53.03 21.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.846 0.355 . . . . 0.0 110.278 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.55 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.2 OUTLIER -53.19 -42.42 66.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.551 179.809 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.843 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.8 OUTLIER -71.12 -45.77 62.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.24 0.543 . . . . 0.0 109.598 179.085 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.7 HD21 ' HA ' ' B' ' 432' ' ' LEU . 76.9 mt -52.64 -59.88 3.93 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.461 178.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -56.6 -44.26 80.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.007 -0.997 . . . . 0.0 109.718 178.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.524 ' C ' ' CD1' ' B' ' 440' ' ' PHE . 0.2 OUTLIER -43.38 -43.95 5.41 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.564 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.646 ' CE1' HD12 ' B' ' 383' ' ' LEU . 49.7 m-85 -66.37 -46.12 77.78 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.47 179.226 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . 0.441 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -42.27 -60.64 1.4 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 178.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -49.09 -47.43 45.16 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.528 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -52.75 -58.78 5.75 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.485 179.157 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.558 ' HG2' ' CD1' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -42.73 -38.78 2.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.68 179.504 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -74.63 -36.8 62.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.637 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 447' ' ' ALA . . . . . 0.414 ' N ' ' O ' ' B' ' 444' ' ' GLN . . . . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.446 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 366' ' ' LEU . . . . . 0.702 HD12 ' ND2' ' B' ' 369' ' ' ASN . 2.2 tp . . . . . 0 CA--C 1.527 0.091 0 CA-C-O 121.374 0.606 . . . . 0.0 111.26 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.827 ' HB3' HG23 ' B' ' 425' ' ' ILE . 0.0 OUTLIER -38.27 -72.7 0.06 Allowed 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.625 179.015 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.532 ' N ' ' HE2' ' B' ' 371' ' ' LYS . 0.3 OUTLIER -37.66 -36.88 0.19 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.052 179.813 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . 0.702 ' ND2' HD12 ' B' ' 366' ' ' LEU . 7.7 m-80 -63.79 -43.29 96.79 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 0.799 ' HA ' HD13 ' B' ' 432' ' ' LEU . . . -60.55 -68.68 0.28 Allowed 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.532 ' HE2' ' N ' ' B' ' 368' ' ' MET . 0.1 OUTLIER -34.03 -49.39 0.35 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.711 -179.844 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.546 ' O ' ' CB ' ' B' ' 376' ' ' SER . 5.0 tmm_? -60.65 -36.59 79.05 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.922 179.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.595 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -63.9 -49.81 71.21 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.88 179.581 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 0.624 ' N ' HD23 ' B' ' 374' ' ' LEU . 0.4 OUTLIER -58.51 -67.04 0.4 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.607 -178.843 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . 0.497 ' O ' ' HA3' ' B' ' 379' ' ' GLY . 3.3 m-85 -71.51 -50.79 27.97 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -177.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.546 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.5 OUTLIER -66.57 -53.97 28.73 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -178.789 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.541 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.1 OUTLIER -76.06 -38.27 57.3 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 -178.466 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.541 HD13 ' O ' ' B' ' 377' ' ' LEU . 4.8 mm -131.79 38.84 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.064 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.497 ' HA3' ' O ' ' B' ' 375' ' ' TYR . . . -121.99 63.15 0.52 Allowed Glycine 0 N--CA 1.453 -0.181 0 C-N-CA 120.372 -0.918 . . . . 0.0 112.552 179.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.636 ' O ' ' HB3' ' B' ' 381' ' ' ALA . 3.0 p90 -86.05 -3.23 58.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.527 0.204 . . . . 0.0 111.1 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . 0.636 ' HB3' ' O ' ' B' ' 380' ' ' TYR . . . 99.05 -171.05 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.592 -179.277 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . 0.443 ' C ' ' O ' ' B' ' 381' ' ' ALA . 10.4 m 26.2 35.68 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.542 -0.754 . . . . 0.0 112.038 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.589 ' N ' ' O ' ' B' ' 381' ' ' ALA . 0.8 OUTLIER -103.21 -24.88 13.53 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.836 0.35 . . . . 0.0 110.914 -179.398 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . 0.497 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 3.5 tpt85 61.05 51.74 4.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.227 179.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.572 ' HA ' HG12 ' B' ' 406' ' ' VAL . 7.8 tt -94.87 123.99 38.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.067 179.229 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . 0.496 ' O ' ' O ' ' B' ' 405' ' ' ARG . 2.2 p-80 -148.34 151.67 35.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.855 0.836 . . . . 0.0 113.179 -178.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.523 ' OH ' HD13 ' B' ' 374' ' ' LEU . 8.1 m-85 -105.45 156.66 17.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.724 -1.125 . . . . 0.0 110.11 178.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . 1.031 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -133.98 124.52 46.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.236 0.541 . . . . 0.0 110.847 179.588 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -85.21 119.93 26.14 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.439 -179.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 0.974 HG23 HG23 ' B' ' 401' ' ' ILE . 32.8 m -130.86 151.91 36.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.365 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.6 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.1 OUTLIER 85.2 16.02 0.16 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.335 179.638 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.53 ' C ' ' O ' ' B' ' 391' ' ' LYS . 22.3 mmtt -3.51 121.63 0.0 OUTLIER Pre-proline 0 N--CA 1.472 0.674 0 O-C-N 123.987 0.805 . . . . 0.0 112.348 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.482 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 25.5 Cg_exo -56.61 162.62 8.07 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.412 2.075 . . . . 0.0 112.788 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . 0.495 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 1.1 p -156.5 168.57 26.95 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.399 -0.818 . . . . 0.0 111.73 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -81.24 8.03 9.93 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.103 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . 0.443 ' O ' ' HB2' ' B' ' 397' ' ' ASP . 24.2 m -132.11 14.83 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.448 0.642 . . . . 0.0 109.578 178.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . 0.443 ' HB2' ' O ' ' B' ' 396' ' ' VAL . 0.1 OUTLIER 166.03 58.33 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.765 -179.644 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.495 ' HA ' ' H ' ' B' ' 394' ' ' THR . 5.2 Cg_exo -39.86 -52.69 2.63 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 123.525 2.817 . . . . 0.0 112.281 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.54 ' HB3' ' HA ' ' B' ' 418' ' ' ARG . 0.8 OUTLIER -25.11 132.14 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.323 -0.853 . . . . 0.0 112.113 -178.84 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . 0.479 ' HB2' ' HG3' ' B' ' 393' ' ' PRO . 18.4 t -135.86 144.52 45.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.951 179.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 0.974 HG23 HG23 ' B' ' 390' ' ' VAL . 0.2 OUTLIER -112.27 139.46 36.85 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 CA-C-O 120.949 0.404 . . . . 0.0 110.662 -179.861 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.692 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.7 OUTLIER -100.01 161.23 3.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.773 -179.669 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 1.031 ' CB ' HG23 ' B' ' 388' ' ' VAL . 2.8 mm-40 -128.13 109.05 11.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.528 178.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.716 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 10.6 t -97.62 108.24 20.92 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.583 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.571 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -153.59 173.46 15.73 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.141 0.496 . . . . 0.0 111.532 -179.321 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.572 HG12 ' HA ' ' B' ' 385' ' ' LEU . 1.4 m -150.85 -175.84 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.989 -179.282 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . 0.418 ' N ' HG23 ' B' ' 406' ' ' VAL . . . 55.74 -103.85 0.27 Allowed Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.379 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -157.87 19.33 0.26 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.944 0.402 . . . . 0.0 110.883 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 173.05 25.52 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.878 -0.677 . . . . 0.0 113.145 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.571 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 24.4 m -113.17 110.3 20.19 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 117.102 0.451 . . . . 0.0 110.607 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . 0.456 ' HA ' ' HB3' ' B' ' 405' ' ' ARG . 10.5 t -102.33 95.48 3.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.678 0.275 . . . . 0.0 111.346 -179.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.624 HD13 ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -56.28 -22.34 29.54 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.933 0.397 . . . . 0.0 110.009 179.466 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 164.68 -167.38 38.45 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.485 -0.864 . . . . 0.0 112.729 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.678 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.1 OUTLIER -153.53 148.14 26.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.887 0.375 . . . . 0.0 110.872 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.524 ' HA2' ' HG2' ' B' ' 426' ' ' ARG . . . -130.91 151.24 19.55 Favored Glycine 0 C--O 1.225 -0.449 0 C-N-CA 120.187 -1.006 . . . . 0.0 113.149 -179.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . 0.78 ' HB ' HD12 ' B' ' 401' ' ' ILE . 1.9 p -152.11 126.13 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.134 0.492 . . . . 0.0 111.554 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.932 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -138.24 170.1 23.98 Favored Glycine 0 N--CA 1.449 -0.464 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.834 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.54 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 0.6 OUTLIER -83.88 -47.42 11.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.977 0.388 . . . . 0.0 111.572 -179.69 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.936 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.2 OUTLIER -80.17 -25.77 39.63 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.53 -179.579 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.936 HG23 ' O ' ' B' ' 419' ' ' ASN . 1.5 pp 112.23 -43.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 124.703 1.201 . . . . 0.0 110.138 -179.138 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.559 ' N ' HD12 ' B' ' 420' ' ' ILE . 0.3 OUTLIER -45.8 -59.15 2.96 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 179.382 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.932 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -47.63 -16.75 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.473 0 CA-C-N 114.992 -1.003 . . . . 0.0 109.862 177.685 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.741 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -87.2 -49.89 6.98 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 177.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.12 -44.36 94.81 Favored Glycine 0 C--N 1.338 0.68 0 C-N-CA 119.776 -1.202 . . . . 0.0 110.503 178.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.827 HG23 ' HB3' ' B' ' 367' ' ' ASP . 1.1 mm -68.46 -65.03 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.277 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.616 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 12.9 tpt180 -40.17 -28.51 0.06 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.026 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.506 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -75.19 -52.96 9.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.714 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 0.713 ' HB1' ' CB ' ' B' ' 370' ' ' ALA . . . -50.32 -50.5 50.68 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.411 0.624 . . . . 0.0 109.439 178.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 1.005 ' HA ' HD22 ' B' ' 432' ' ' LEU . 57.8 mt-10 -60.19 -60.21 4.18 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 177.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.524 ' C ' ' O ' ' B' ' 429' ' ' GLU . 3.8 m120 -24.41 -45.73 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.308 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.716 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -70.63 -54.46 11.89 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-O 121.129 0.49 . . . . 0.0 110.103 178.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 1.005 HD22 ' HA ' ' B' ' 429' ' ' GLU . 0.0 OUTLIER -73.7 3.12 6.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.198 178.956 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . 0.573 ' N ' HD23 ' B' ' 432' ' ' LEU . 0.8 OUTLIER -87.21 -8.48 56.8 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.851 -179.104 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.483 ' O ' ' HG ' ' B' ' 438' ' ' LEU . 48.0 t0 -115.84 93.05 4.09 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.784 0.326 . . . . 0.0 110.905 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.609 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 0.6 OUTLIER -61.03 -42.2 98.02 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.178 -0.464 . . . . 0.0 109.875 179.54 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.609 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 25.4 mttt -54.61 -48.28 72.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.387 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.492 ' CE ' ' HG ' ' B' ' 412' ' ' LEU . 13.1 tmm? -71.46 -50.14 34.55 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.285 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.985 HD11 ' HA ' ' B' ' 432' ' ' LEU . 74.9 mt -50.81 -60.87 2.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.43 0.633 . . . . 0.0 110.123 179.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . 0.412 ' O ' ' N ' ' B' ' 442' ' ' ALA . 11.3 t70 -59.09 -41.5 88.22 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.321 178.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.529 ' C ' ' CD1' ' B' ' 440' ' ' PHE . 0.0 OUTLIER -44.04 -46.56 8.5 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 179.49 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.513 ' O ' ' CG ' ' B' ' 444' ' ' GLN . 55.9 m-85 -66.96 -39.78 87.32 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.22 179.042 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . 0.412 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -46.98 -60.16 2.63 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 177.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -47.32 -40.63 17.51 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.668 ' HG3' ' N ' ' B' ' 445' ' ' ARG . 0.0 OUTLIER -58.23 -52.15 66.78 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.678 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.668 ' N ' ' HG3' ' B' ' 444' ' ' GLN . 0.4 OUTLIER -45.74 -42.18 11.58 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.744 179.813 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -71.74 -38.29 70.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.09 0.472 . . . . 0.0 110.209 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.047 179.937 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 366' ' ' LEU . . . . . . . . . . . . . 1.2 mp . . . . . 0 CA--C 1.522 -0.098 0 CA-C-O 121.056 0.455 . . . . 0.0 111.508 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.506 ' HB3' ' CG1' ' B' ' 425' ' ' ILE . 0.3 OUTLIER -54.75 -71.23 0.08 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.213 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.447 ' C ' ' O ' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -32.39 -49.36 0.2 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.931 179.805 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 57.2 m-20 -62.14 -47.42 84.64 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.685 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 1.084 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -61.64 -71.14 0.16 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.656 0.265 . . . . 0.0 110.303 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.485 ' HD2' ' HB2' ' B' ' 367' ' ' ASP . 0.2 OUTLIER -33.09 -46.46 0.16 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.038 179.849 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.554 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.0 OUTLIER -66.69 -38.31 86.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.648 -179.484 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.848 HE22 HD22 ' B' ' 438' ' ' LEU . 3.8 tm0? -61.63 -59.02 5.84 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.352 0.596 . . . . 0.0 110.639 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 0.658 HD11 ' HB3' ' B' ' 431' ' ' ALA . 2.3 mm? -58.18 -65.34 0.66 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.9 -1.046 . . . . 0.0 112.749 -178.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . 0.541 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 63.2 m-85 -73.64 -42.37 61.5 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -177.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.554 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -78.36 -52.9 7.9 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.503 -0.479 . . . . 0.0 111.671 -179.267 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.607 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.6 OUTLIER -76.32 -31.28 58.08 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -178.376 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.607 HD13 ' O ' ' B' ' 377' ' ' LEU . 4.3 mm -141.56 39.12 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.81 -179.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.541 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -115.34 94.24 0.65 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.351 -0.928 . . . . 0.0 113.338 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.773 ' CE1' HD12 ' B' ' 383' ' ' LEU . 0.4 OUTLIER -145.77 -178.11 5.94 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.278 -0.268 . . . . 0.0 110.278 179.448 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -91.76 75.92 5.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.9 0.381 . . . . 0.0 111.373 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . 0.588 ' HB2' ' CE2' ' B' ' 380' ' ' TYR . 0.7 OUTLIER -170.31 -68.68 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.864 179.686 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.852 HD22 ' N ' ' B' ' 384' ' ' ARG . 0.0 OUTLIER -51.12 -41.4 60.03 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.183 -0.302 . . . . 0.0 110.183 179.612 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . 0.852 ' N ' HD22 ' B' ' 383' ' ' LEU . 2.1 tpt85 72.78 89.41 0.09 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 178.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.75 ' HA ' HG12 ' B' ' 406' ' ' VAL . 0.1 OUTLIER -63.89 147.08 52.77 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.647 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . 0.538 ' CB ' ' O ' ' B' ' 405' ' ' ARG . 0.1 OUTLIER -147.94 70.18 1.14 Allowed 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -178.943 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.583 ' CE2' ' HB1' ' B' ' 427' ' ' ALA . 4.0 m-85 -91.59 113.65 25.97 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.383 177.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . 0.465 HG23 ' HB3' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -109.28 133.11 55.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.735 0.302 . . . . 0.0 110.706 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 5.3 m -87.76 125.35 34.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.0 0.429 . . . . 0.0 110.536 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 0.926 HG23 HG23 ' B' ' 401' ' ' ILE . 27.1 m -131.38 159.68 42.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.582 -179.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.828 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 88.4 23.48 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.45 179.41 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.519 ' O ' ' O ' ' B' ' 391' ' ' LYS . 9.6 mmtt 1.78 118.28 0.0 OUTLIER Pre-proline 0 N--CA 1.472 0.673 0 O-C-N 124.249 0.968 . . . . 0.0 112.476 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.467 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 22.8 Cg_exo -61.01 162.59 18.78 Favored 'Trans proline' 0 N--CA 1.463 -0.272 0 C-N-CA 122.677 2.251 . . . . 0.0 113.153 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . 0.439 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 2.9 p -127.82 170.46 12.76 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.768 -1.106 . . . . 0.0 111.194 -179.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -97.09 19.64 12.59 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.227 0.537 . . . . 0.0 110.905 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 31.5 m -137.5 8.24 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.946 178.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . 0.495 ' O ' ' N ' ' B' ' 399' ' ' ASN . 1.2 m-20 164.91 62.47 0.0 OUTLIER Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 114.82 -1.082 . . . . 0.0 108.929 -179.289 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.546 ' HB2' ' O ' ' B' ' 418' ' ' ARG . 47.2 Cg_exo -34.04 -25.78 0.03 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 123.882 3.055 . . . . 0.0 113.943 -179.079 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.535 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 23.0 m120 -16.19 122.04 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 179.645 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -143.61 151.72 40.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.014 0.435 . . . . 0.0 111.303 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 0.926 HG23 HG23 ' B' ' 390' ' ' VAL . 0.7 OUTLIER -116.8 144.95 23.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.188 -179.591 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.664 ' O ' HG22 ' B' ' 414' ' ' THR . 0.2 OUTLIER -110.25 150.22 12.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.294 -179.714 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 0.475 ' O ' ' HA ' ' B' ' 387' ' ' TYR . 0.1 OUTLIER -109.43 103.7 12.65 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-O 120.922 0.392 . . . . 0.0 109.965 178.967 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.47 ' SG ' ' O ' ' B' ' 413' ' ' GLY . 0.0 OUTLIER -81.4 91.2 6.25 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 179.296 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.563 ' CG ' ' O ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -133.97 152.27 51.79 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.202 -179.046 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.75 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.9 OUTLIER -126.41 -174.5 1.08 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.507 0 CA-C-O 120.852 0.358 . . . . 0.0 111.202 -179.735 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 57.33 -94.4 0.04 OUTLIER Glycine 0 C--N 1.335 0.495 0 C-N-CA 120.791 -0.719 . . . . 0.0 111.872 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -164.45 26.51 0.07 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.019 0.438 . . . . 0.0 109.843 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 168.35 -16.48 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.526 -0.845 . . . . 0.0 113.146 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.563 ' O ' ' CG ' ' B' ' 405' ' ' ARG . 56.5 m -70.17 133.6 47.26 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 179.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . 0.602 HG12 ' N ' ' B' ' 412' ' ' LEU . 39.2 t -85.04 -115.15 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 C-N-CA 120.22 -0.592 . . . . 0.0 112.012 -178.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.602 ' N ' HG12 ' B' ' 411' ' ' VAL . 0.0 OUTLIER 138.24 -45.85 0.01 OUTLIER 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 -178.357 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . 0.477 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 173.38 -176.45 46.04 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 114.97 -1.014 . . . . 0.0 112.564 179.442 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.664 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.2 OUTLIER -144.04 155.26 43.92 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.749 -0.226 . . . . 0.0 110.731 -179.719 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.486 ' CA ' ' HG3' ' B' ' 426' ' ' ARG . . . -146.18 140.96 9.19 Favored Glycine 0 C--O 1.226 -0.365 0 C-N-CA 120.063 -1.065 . . . . 0.0 112.853 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . 0.425 ' HB ' HD12 ' B' ' 401' ' ' ILE . 9.4 p -130.94 152.35 37.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.55 0.214 . . . . 0.0 110.474 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.863 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -164.45 155.29 26.6 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.589 -0.815 . . . . 0.0 112.48 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.546 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 1.5 ptm180 -64.2 -44.05 93.15 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.775 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.6 OUTLIER -102.4 31.58 3.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.584 0.23 . . . . 0.0 110.412 179.304 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.743 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 54.28 -45.39 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 N-CA-C 114.676 1.361 . . . . 0.0 114.676 178.752 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.785 ' HG2' HD13 ' B' ' 425' ' ' ILE . 0.0 OUTLIER -44.41 -57.24 3.66 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.863 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -47.87 -24.27 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.328 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.743 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -79.62 -48.46 13.71 Favored 'General case' 0 N--CA 1.439 -1.017 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 177.05 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . 0.66 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -59.17 -50.33 68.9 Favored Glycine 0 N--CA 1.449 -0.477 0 N-CA-C 110.165 -1.174 . . . . 0.0 110.165 178.116 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.785 HD13 ' HG2' ' B' ' 421' ' ' LYS . 1.2 mp -59.47 -66.82 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 177.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.58 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 10.4 tpt180 -38.07 -31.87 0.06 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.091 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.66 ' HB3' ' O ' ' B' ' 424' ' ' GLY . . . -62.92 -62.39 1.75 Allowed 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.509 178.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 1.084 ' CB ' ' HB1' ' B' ' 370' ' ' ALA . . . -53.49 -50.26 65.74 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.6 ' O ' HD22 ' B' ' 432' ' ' LEU . 0.6 OUTLIER -56.03 -18.87 10.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.76 179.235 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.516 ' ND2' ' O ' ' B' ' 414' ' ' THR . 0.8 OUTLIER -81.34 -38.72 26.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.57 -0.287 . . . . 0.0 110.808 179.644 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.658 ' HB3' HD11 ' B' ' 374' ' ' LEU . . . -72.91 -33.42 65.98 Favored 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -178.246 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.877 HD23 ' C ' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -81.76 8.84 9.07 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.887 0.375 . . . . 0.0 111.527 -179.443 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . 0.684 ' N ' HD23 ' B' ' 432' ' ' LEU . 1.3 mtm180 -85.6 -3.91 59.01 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.939 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -115.25 79.55 1.3 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.386 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.542 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -48.0 -54.27 13.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.719 0.295 . . . . 0.0 111.071 -179.799 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.542 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 13.7 mtpp -55.2 -40.9 71.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.84 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.472 ' O ' ' HB3' ' B' ' 440' ' ' PHE . 17.5 tmm? -69.48 -52.97 21.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.993 0.425 . . . . 0.0 110.139 179.282 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.848 HD22 HE22 ' B' ' 373' ' ' GLN . 74.3 mt -50.73 -61.9 1.92 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.544 0.688 . . . . 0.0 110.329 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -49.43 -48.16 47.57 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.922 -1.035 . . . . 0.0 109.543 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.515 ' C ' ' CD1' ' B' ' 440' ' ' PHE . 0.1 OUTLIER -43.75 -42.67 5.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.484 179.743 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.622 ' CE2' ' HB2' ' B' ' 383' ' ' LEU . 36.8 m-85 -69.88 -36.74 75.69 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.094 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -51.34 -60.73 2.8 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 178.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . 0.424 ' C ' ' CD ' ' B' ' 443' ' ' LYS . 0.0 OUTLIER -48.08 -43.21 30.42 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.064 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.542 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -55.38 -55.83 27.07 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.262 178.954 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.596 ' HD2' ' CD2' ' B' ' 380' ' ' TYR . 0.2 OUTLIER -44.39 -36.98 3.1 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.347 179.582 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -81.43 -36.37 29.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.642 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.238 -179.663 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 366' ' ' LEU . . . . . 0.526 ' O ' ' HB2' ' B' ' 369' ' ' ASN . 3.7 tp . . . . . 0 CA--C 1.522 -0.125 0 CA-C-O 120.74 0.305 . . . . 0.0 111.54 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.546 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.1 OUTLIER -36.7 -77.11 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.917 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.548 ' CE ' ' N ' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -36.05 -41.28 0.24 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.988 178.994 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . 0.548 ' N ' ' CE ' ' B' ' 368' ' ' MET . 1.7 m-80 -61.8 -44.44 96.85 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.409 179.181 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 0.756 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -56.89 -68.46 0.22 Allowed 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.632 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.5 ' CE ' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -34.56 -47.93 0.34 Allowed 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.029 0.442 . . . . 0.0 110.35 -179.919 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.591 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.0 OUTLIER -56.57 -39.78 74.07 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.008 179.654 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.924 ' OE1' HD23 ' B' ' 377' ' ' LEU . 0.8 OUTLIER -63.62 -60.29 3.51 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.581 0.705 . . . . 0.0 110.751 179.31 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 0.936 HD11 ' HB2' ' B' ' 428' ' ' ALA . 0.2 OUTLIER -49.19 -72.47 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.114 -0.948 . . . . 0.0 113.428 -178.424 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 -89.01 -2.99 58.84 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -176.496 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.591 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -119.04 5.73 11.32 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 119.915 -0.714 . . . . 0.0 111.415 179.811 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.924 HD23 ' OE1' ' B' ' 373' ' ' GLN . 9.9 tp -144.11 -32.91 0.42 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.493 179.215 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.527 ' CG1' ' OE1' ' B' ' 373' ' ' GLN . 3.8 mm -134.58 37.15 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 120.836 0.35 . . . . 0.0 111.378 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . . . . . . . . . . . -120.75 93.02 0.52 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.623 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.616 ' CZ ' ' HG ' ' B' ' 383' ' ' LEU . 0.1 OUTLIER -126.93 -98.58 0.39 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.519 0.199 . . . . 0.0 110.985 179.633 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -155.58 -41.42 0.08 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.737 0.303 . . . . 0.0 111.426 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.26 -51.1 69.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.912 0.387 . . . . 0.0 110.645 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.871 HD22 ' O ' ' B' ' 383' ' ' LEU . 0.0 OUTLIER -92.13 37.43 0.98 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.873 179.843 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . 0.495 ' CG ' ' O ' ' B' ' 384' ' ' ARG . 2.0 ptm180 -26.21 97.7 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.921 -179.632 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.725 HD22 ' HE1' ' B' ' 387' ' ' TYR . 0.3 OUTLIER -59.89 163.04 4.88 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.955 179.374 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . 0.488 ' CB ' ' O ' ' B' ' 405' ' ' ARG . 0.0 OUTLIER -160.27 83.71 0.71 Allowed 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -179.188 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.725 ' HE1' HD22 ' B' ' 385' ' ' LEU . 60.4 m-85 -87.77 114.91 24.83 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 177.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . 0.49 HG23 ' HB3' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -123.9 115.48 45.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.494 -0.483 . . . . 0.0 112.302 -179.372 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . 0.574 HG23 ' OG ' ' B' ' 400' ' ' SER . 3.9 m -70.37 128.86 37.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.543 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 0.75 HG23 HG23 ' B' ' 401' ' ' ILE . 19.9 m -132.71 159.89 42.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.6 -179.385 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.54 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 92.68 36.85 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.771 179.743 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.51 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER 0.94 117.82 0.0 OUTLIER Pre-proline 0 N--CA 1.472 0.634 0 O-C-N 124.038 0.836 . . . . 0.0 112.704 179.596 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.519 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 26.4 Cg_exo -60.37 163.76 14.3 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.669 2.246 . . . . 0.0 113.249 -179.688 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . 0.452 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 18.2 p -135.43 172.42 13.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.055 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -98.05 18.36 16.24 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 121.174 0.512 . . . . 0.0 110.472 179.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 11.4 m -125.47 -0.85 5.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.967 178.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . 0.528 ' O ' ' N ' ' B' ' 399' ' ' ASN . 11.6 m-20 170.61 54.47 0.01 OUTLIER Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 114.625 -1.17 . . . . 0.0 108.599 -179.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.519 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 76.8 Cg_exo -29.56 -32.36 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 124.089 3.193 . . . . 0.0 113.517 -178.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.55 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 6.5 p30 -25.45 142.06 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.863 -178.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . 0.574 ' OG ' HG23 ' B' ' 389' ' ' THR . 1.0 OUTLIER -140.79 158.07 44.49 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.643 -179.222 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 1.082 HD12 HG23 ' B' ' 416' ' ' VAL . 0.2 OUTLIER -110.48 144.49 18.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.432 -0.803 . . . . 0.0 111.303 -179.399 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.884 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.3 OUTLIER -109.7 146.21 15.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.777 -179.202 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 0.49 ' HB3' HG23 ' B' ' 388' ' ' VAL . 6.0 tt0 -111.79 95.95 5.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.073 179.093 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.496 ' SG ' ' CZ ' ' B' ' 387' ' ' TYR . 4.6 t -75.89 87.1 2.86 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.347 -0.842 . . . . 0.0 108.873 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.574 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -133.17 152.83 51.93 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.109 -179.205 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.85 HG22 ' HB ' ' B' ' 410' ' ' THR . 0.9 OUTLIER -145.94 151.27 14.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.714 -179.103 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 67.79 -103.91 1.06 Allowed Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.736 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -149.68 2.76 0.54 Allowed 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -166.37 22.61 0.12 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 119.896 -1.145 . . . . 0.0 113.18 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.903 HG21 ' OH ' ' B' ' 441' ' ' TYR . 0.2 OUTLIER -116.31 97.61 6.13 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 117.116 0.458 . . . . 0.0 110.926 179.536 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . 0.776 ' O ' HG12 ' B' ' 411' ' ' VAL . 56.1 t -106.36 64.92 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.705 179.18 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.841 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.1 OUTLIER -30.66 -35.33 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 120.676 0.274 . . . . 0.0 110.907 -179.56 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . 0.544 ' N ' ' O ' ' B' ' 411' ' ' VAL . . . 165.97 -157.38 29.82 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 119.721 -1.228 . . . . 0.0 113.494 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.5 ' O ' ' ND2' ' B' ' 430' ' ' ASN . 1.1 t -153.89 174.05 15.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.27 -0.465 . . . . 0.0 111.803 -178.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.762 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -158.02 139.76 6.56 Favored Glycine 0 C--O 1.222 -0.641 0 C-N-CA 120.298 -0.953 . . . . 0.0 113.123 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . 1.082 HG23 HD12 ' B' ' 401' ' ' ILE . 41.5 t -126.13 149.92 31.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 179.118 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.96 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -163.0 162.16 34.46 Favored Glycine 0 C--O 1.225 -0.407 0 C-N-CA 120.126 -1.035 . . . . 0.0 112.465 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.487 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 1.6 ptt180 -76.95 -41.87 41.45 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.707 0.254 . . . . 0.0 111.684 -179.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.789 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.2 OUTLIER -101.65 27.59 6.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.034 0.445 . . . . 0.0 109.824 179.009 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.687 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 55.75 -44.76 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 178.485 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.678 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.2 OUTLIER -43.49 -58.92 2.37 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 179.565 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.96 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -45.82 -26.23 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.667 178.658 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.884 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -77.51 -47.66 19.0 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 177.224 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . 0.586 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -63.6 -55.67 23.84 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.732 178.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.538 ' CG1' ' HB3' ' B' ' 367' ' ' ASP . 0.9 OUTLIER -58.25 -71.71 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 178.621 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.555 ' HB3' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -44.16 -26.19 0.29 Allowed 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.699 -178.743 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.592 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -61.62 -54.48 42.37 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 176.809 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 0.936 ' HB2' HD11 ' B' ' 374' ' ' LEU . . . -53.47 -49.49 67.34 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 107.964 -1.125 . . . . 0.0 107.964 177.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.817 ' HA ' HD22 ' B' ' 432' ' ' LEU . 49.7 mt-10 -53.99 -21.97 9.38 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.365 178.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.592 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.7 OUTLIER -75.73 -37.28 59.54 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 178.341 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.462 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -68.49 -48.47 64.36 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.299 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.817 HD22 ' HA ' ' B' ' 429' ' ' GLU . 0.1 OUTLIER -76.91 1.31 17.99 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.117 0.484 . . . . 0.0 111.343 -179.953 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . 0.806 ' N ' HD23 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -71.82 -14.26 61.92 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.883 -179.92 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.523 ' HB2' ' HB3' ' B' ' 437' ' ' MET . 5.6 m-20 -120.76 86.64 2.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.927 -178.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.583 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 6.1 ptpp? -52.61 -52.62 54.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.983 0.421 . . . . 0.0 110.213 179.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.583 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 5.4 mtpp -50.63 -36.41 35.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.546 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.841 ' SD ' HD12 ' B' ' 412' ' ' LEU . 1.1 ttp -80.11 -44.76 19.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.724 179.008 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.804 HD11 ' HA ' ' B' ' 432' ' ' LEU . 87.2 mt -53.08 -63.01 1.28 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.669 0.747 . . . . 0.0 109.545 178.709 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . 0.405 ' O ' ' C ' ' B' ' 440' ' ' PHE . 9.1 t70 -55.57 -44.51 76.93 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.029 -0.987 . . . . 0.0 108.973 178.507 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.463 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.1 OUTLIER -41.6 -42.26 2.41 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.187 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.903 ' OH ' HG21 ' B' ' 410' ' ' THR . 46.3 m-85 -68.11 -46.45 70.87 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.232 -0.894 . . . . 0.0 110.675 179.348 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -42.82 -60.82 1.45 Allowed 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 178.701 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.67 -44.21 57.63 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.84 178.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -55.11 -55.38 31.7 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.06 179.278 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.555 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.1 OUTLIER -50.49 -41.56 53.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.559 -179.89 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -65.72 -46.09 80.25 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.092 0.472 . . . . 0.0 110.263 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.76 -179.315 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 366' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.457 -0.075 0 CA-C-O 120.876 0.37 . . . . 0.0 111.208 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.497 ' OD1' ' N ' ' B' ' 367' ' ' ASP . 0.1 OUTLIER -58.16 -64.96 0.73 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.941 179.363 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.471 ' HA ' ' HD2' ' B' ' 371' ' ' LYS . 1.4 ttp -33.74 -48.21 0.27 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.912 179.75 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 32.2 m-20 -61.8 -45.48 93.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.811 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 0.78 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -59.69 -69.67 0.2 Allowed 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.471 ' HD2' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -32.92 -52.74 0.34 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.977 0.418 . . . . 0.0 110.699 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -37.44 75.31 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.074 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.6 ' HA ' ' HB2' ' B' ' 377' ' ' LEU . 0.0 OUTLIER -64.09 -65.91 0.61 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.598 0.713 . . . . 0.0 110.904 179.558 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 0.828 HD12 HD11 ' B' ' 385' ' ' LEU . 4.3 mm? -48.14 -68.23 0.2 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.208 -0.906 . . . . 0.0 112.621 -179.217 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -79.4 -42.66 25.01 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 -176.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.47 ' O ' ' CD2' ' B' ' 377' ' ' LEU . 0.0 OUTLIER -91.54 10.46 27.83 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -177.619 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.6 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.3 OUTLIER -140.67 -38.18 0.44 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.66 0.266 . . . . 0.0 111.213 179.264 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.572 ' O ' HD13 ' B' ' 383' ' ' LEU . 5.7 mm -121.73 34.64 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 121.081 0.467 . . . . 0.0 110.966 179.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . . . . . . . . . . . -149.31 69.75 0.33 Allowed Glycine 0 N--CA 1.453 -0.232 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.908 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.6 ' CG ' ' HD3' ' B' ' 445' ' ' ARG . 2.2 p90 -61.98 -59.87 4.46 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 -179.035 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . 0.576 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 170.29 -29.64 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.875 0.369 . . . . 0.0 111.59 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . 0.488 ' HG ' ' HE2' ' B' ' 380' ' ' TYR . 0.3 OUTLIER -110.39 40.9 1.86 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.321 179.6 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.581 HD21 ' HB ' ' B' ' 406' ' ' VAL . 6.7 tt -115.35 -40.51 3.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.827 -179.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 65.3 65.97 0.55 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.198 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.828 HD11 HD12 ' B' ' 374' ' ' LEU . 0.7 OUTLIER -48.65 155.84 0.52 Allowed 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.482 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . 0.505 ' HB3' ' HG2' ' B' ' 405' ' ' ARG . 0.9 OUTLIER -153.3 98.17 2.24 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -178.681 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.75 ' HB2' ' HA ' ' B' ' 404' ' ' CYS . 0.1 OUTLIER -139.72 151.54 45.94 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.929 176.553 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -144.51 163.65 13.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.749 -177.079 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 3.4 m -102.78 129.95 49.59 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.077 0.465 . . . . 0.0 110.898 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 0.629 HG23 HG23 ' B' ' 401' ' ' ILE . 5.4 m -134.92 162.42 38.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.01 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.56 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 98.92 28.55 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.206 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.526 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.1 OUTLIER 0.37 117.52 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.679 0 O-C-N 124.119 0.887 . . . . 0.0 112.247 179.851 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.496 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 18.7 Cg_exo -62.72 158.35 42.68 Favored 'Trans proline' 0 N--CA 1.463 -0.304 0 C-N-CA 122.477 2.118 . . . . 0.0 113.401 -179.229 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . 0.491 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 15.9 p -137.96 167.53 21.57 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.5 -1.227 . . . . 0.0 111.096 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -92.29 17.19 10.12 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-O 121.262 0.553 . . . . 0.0 110.22 179.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . 0.407 ' O ' ' CG ' ' B' ' 397' ' ' ASP . 17.4 m -125.67 -6.52 5.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.166 -0.924 . . . . 0.0 109.944 177.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . 0.465 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 28.9 m-20 179.45 54.46 0.05 OUTLIER Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 114.623 -1.172 . . . . 0.0 108.749 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.496 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 57.6 Cg_exo -31.76 -38.38 0.07 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 123.746 2.964 . . . . 0.0 113.643 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.607 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -28.31 139.91 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.493 0.663 . . . . 0.0 112.652 -177.775 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . 0.426 ' O ' ' HB2' ' B' ' 423' ' ' ALA . 12.0 t -141.09 148.79 40.7 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.964 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 0.629 HG23 HG23 ' B' ' 390' ' ' VAL . 12.1 tt -107.57 156.22 8.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 121.133 0.492 . . . . 0.0 111.875 -179.508 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.734 HG23 ' O ' ' B' ' 415' ' ' GLY . 0.2 OUTLIER -127.99 141.1 47.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.652 -179.381 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 0.573 ' O ' ' HB2' ' B' ' 387' ' ' TYR . 0.7 OUTLIER -100.76 94.1 5.9 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.027 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.75 ' HA ' ' HB2' ' B' ' 387' ' ' TYR . 1.1 p -82.26 99.08 9.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.861 0.839 . . . . 0.0 110.391 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.741 ' HB2' HG22 ' B' ' 411' ' ' VAL . 0.2 OUTLIER -132.48 164.63 26.15 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.704 -178.71 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.581 ' HB ' HD21 ' B' ' 383' ' ' LEU . 1.2 m -132.59 128.5 57.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.953 0.406 . . . . 0.0 111.96 -178.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . 0.478 ' O ' ' HB3' ' B' ' 408' ' ' ASP . . . 79.64 8.49 87.68 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.921 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . 0.481 ' C ' ' HD2' ' B' ' 405' ' ' ARG . 9.2 t70 66.88 11.68 8.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.87 0.367 . . . . 0.0 110.632 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -125.97 -37.29 0.51 Allowed Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.492 -0.861 . . . . 0.0 112.99 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.623 HG22 HD13 ' B' ' 412' ' ' LEU . 95.0 m -103.13 136.77 42.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.959 0.409 . . . . 0.0 112.035 -179.097 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . 0.741 HG22 ' HB2' ' B' ' 405' ' ' ARG . 79.1 t -120.15 80.25 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.726 179.382 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.751 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.1 OUTLIER -41.19 -38.66 1.14 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.889 179.75 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . 0.468 ' O ' ' SG ' ' B' ' 404' ' ' CYS . . . 172.34 -169.73 42.82 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.374 -0.917 . . . . 0.0 112.916 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.446 ' C ' ' OD1' ' B' ' 430' ' ' ASN . 2.2 t -145.21 138.09 26.25 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.754 0.312 . . . . 0.0 111.207 -178.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.734 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -117.87 133.43 10.45 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.239 -0.982 . . . . 0.0 113.761 -179.013 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . 0.492 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 11.7 p -117.38 153.96 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 178.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.938 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -161.98 157.64 29.46 Favored Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.18 -1.01 . . . . 0.0 111.67 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.541 ' HA ' ' CB ' ' B' ' 399' ' ' ASN . 1.9 ptm180 -73.67 -40.29 63.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.918 0.39 . . . . 0.0 111.608 -179.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.826 ' H ' HD11 ' B' ' 422' ' ' ILE . 8.2 t30 -100.91 27.17 6.2 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.65 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.697 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 54.91 -47.76 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 179.82 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.503 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -43.62 -59.02 2.37 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.116 -0.633 . . . . 0.0 109.377 -179.714 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.938 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -44.39 -22.2 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.325 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.844 177.906 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -80.95 -49.79 10.54 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 177.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . 0.506 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -56.36 -48.65 74.02 Favored Glycine 0 C--N 1.337 0.631 0 C-N-CA 119.586 -1.292 . . . . 0.0 110.3 178.344 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.606 ' N ' HD12 ' B' ' 425' ' ' ILE . 1.2 mp -65.4 -64.75 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 177.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.616 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 14.8 tpt180 -39.08 -31.27 0.07 Allowed 'General case' 0 C--O 1.225 -0.196 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.607 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -65.25 -52.32 55.23 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 178.053 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 0.78 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -55.91 -51.83 66.23 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 177.516 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.692 ' HA ' HD22 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -57.93 -31.65 67.02 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.862 179.251 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.593 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 19.0 m120 -57.43 -41.21 80.01 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.619 ' HB3' HD21 ' B' ' 374' ' ' LEU . . . -69.03 -45.14 71.23 Favored 'General case' 0 CA--C 1.527 0.084 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.686 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.964 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -77.67 -9.84 59.19 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.841 0.353 . . . . 0.0 111.445 -179.382 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . 0.739 ' N ' HD23 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -80.08 16.82 1.12 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.672 -179.504 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.48 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 90.3 m-20 -140.27 79.85 1.73 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.656 0.265 . . . . 0.0 110.337 179.103 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.589 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -46.69 -58.5 3.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.801 -179.551 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.589 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 1.6 mmpp? -49.65 -37.14 27.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.89 0.376 . . . . 0.0 110.451 -179.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.751 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.5 OUTLIER -73.84 -51.46 16.21 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.498 179.284 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.964 HD11 ' HA ' ' B' ' 432' ' ' LEU . 90.0 mt -52.36 -61.7 2.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.283 0.563 . . . . 0.0 110.691 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . 0.475 ' O ' ' N ' ' B' ' 442' ' ' ALA . 3.5 t70 -48.69 -51.13 30.15 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 178.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.479 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -40.13 -42.65 1.49 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.063 179.83 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.55 ' HA ' ' HG2' ' B' ' 444' ' ' GLN . 49.8 m-85 -67.72 -42.02 82.59 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.781 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . 0.475 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -43.04 -59.31 2.07 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 177.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.2 -42.91 41.69 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 177.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.55 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -73.39 3.59 5.78 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.906 179.017 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.6 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -99.23 -45.02 6.03 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.371 179.238 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -79.38 -34.8 41.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.728 179.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.792 -179.835 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 366' ' ' LEU . . . . . 0.466 HD23 ' HB3' ' B' ' 368' ' ' MET . 0.2 OUTLIER . . . . . 0 N--CA 1.455 -0.189 0 CA-C-O 120.877 0.37 . . . . 0.0 111.081 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.457 ' OD2' HG13 ' B' ' 425' ' ' ILE . 3.9 t70 -59.58 -61.56 2.53 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.809 179.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.524 ' O ' ' HB2' ' B' ' 372' ' ' ARG . 8.8 ttp -34.6 -50.47 0.45 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.611 179.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -61.92 -48.01 82.35 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.694 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 0.935 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -64.94 -72.5 0.15 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.743 0.306 . . . . 0.0 110.69 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.516 ' CD ' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -34.86 -42.55 0.16 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.857 179.828 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.556 ' O ' ' CB ' ' B' ' 376' ' ' SER . 1.8 ttp-105 -66.64 -39.23 88.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.235 -179.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.741 ' CG ' HD12 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -62.49 -54.67 36.63 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.209 0.528 . . . . 0.0 110.415 179.54 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 0.545 HD21 ' O ' ' B' ' 428' ' ' ALA . 1.1 mm? -55.93 -68.53 0.2 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.267 -0.878 . . . . 0.0 113.048 -179.102 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . 0.469 ' O ' ' O ' ' B' ' 378' ' ' ILE . 3.5 m-85 -74.91 -45.13 44.72 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -177.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.556 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -70.8 -54.25 12.33 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.319 -0.552 . . . . 0.0 111.386 -179.404 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.6 ' C ' HD13 ' B' ' 378' ' ' ILE . 0.0 OUTLIER -71.02 -43.59 67.61 Favored 'General case' 0 CA--C 1.509 -0.618 0 CA-C-O 121.196 0.522 . . . . 0.0 109.971 -178.856 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.627 HG23 ' HB3' ' B' ' 441' ' ' TYR . 2.4 mm -120.36 -138.5 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.926 0 CA-C-N 115.374 -0.83 . . . . 0.0 108.878 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.522 ' O ' ' O ' ' B' ' 380' ' ' TYR . . . 99.53 -22.37 40.91 Favored Glycine 0 C--N 1.321 -0.3 0 C-N-CA 120.943 -0.646 . . . . 0.0 112.089 -179.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 1.094 ' CB ' HD22 ' B' ' 383' ' ' LEU . 0.1 OUTLIER 34.92 -175.41 0.0 OUTLIER 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 178.867 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -121.16 -28.2 4.76 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 113.092 -1.867 . . . . 0.0 109.985 179.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -143.57 50.49 1.37 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.653 179.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 1.094 HD22 ' CB ' ' B' ' 380' ' ' TYR . 0.8 OUTLIER -116.4 -36.14 4.09 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 120.913 0.387 . . . . 0.0 110.421 178.857 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . 0.72 ' H ' HD23 ' B' ' 383' ' ' LEU . 1.9 tpt85 74.71 78.76 0.11 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.718 179.173 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.678 ' HG ' HG12 ' B' ' 406' ' ' VAL . 9.7 tt -107.25 124.29 49.54 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 178.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . 0.421 ' O ' ' O ' ' B' ' 405' ' ' ARG . 26.4 p-80 -145.22 145.91 31.5 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 -178.185 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.676 ' HE1' HD21 ' B' ' 385' ' ' LEU . 3.9 m-85 -106.05 147.74 28.55 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 114.56 -1.2 . . . . 0.0 111.066 178.319 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . 0.535 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -133.43 128.64 55.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.351 179.448 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.2 m -86.83 123.75 32.31 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.963 179.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 0.907 HG23 HG23 ' B' ' 401' ' ' ILE . 29.1 m -130.06 154.84 40.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.363 0.602 . . . . 0.0 112.222 -179.314 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.54 ' O ' ' C ' ' B' ' 392' ' ' LYS . 4.4 tptt 90.7 23.68 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.544 179.508 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.54 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.1 OUTLIER 1.71 108.37 0.01 OUTLIER Pre-proline 0 N--CA 1.468 0.439 0 O-C-N 123.966 0.792 . . . . 0.0 112.44 179.766 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.492 ' HD2' ' HA ' ' B' ' 392' ' ' LYS . 6.0 Cg_exo -45.55 160.41 0.16 Allowed 'Trans proline' 0 N--CA 1.462 -0.33 0 C-N-CA 122.856 2.37 . . . . 0.0 113.514 -179.174 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 31.8 p -127.2 169.76 13.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.53 179.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -96.19 20.21 10.65 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 121.24 0.543 . . . . 0.0 110.715 179.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 33.6 m -136.05 6.64 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.005 178.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . 0.455 ' O ' ' N ' ' B' ' 399' ' ' ASN . 0.2 OUTLIER 168.17 58.09 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 114.949 -1.023 . . . . 0.0 108.847 -179.38 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.477 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 3.3 Cg_exo -35.64 -27.3 0.05 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 124.062 3.175 . . . . 0.0 113.108 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.599 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 1.3 p-10 -29.28 120.43 0.14 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.619 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . 0.428 ' OG ' ' HD3' ' B' ' 393' ' ' PRO . 48.9 m -130.71 158.17 40.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.906 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 0.907 HG23 HG23 ' B' ' 390' ' ' VAL . 0.4 OUTLIER -115.14 144.89 21.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.991 -179.796 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.677 HG21 ' C ' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -110.77 157.59 11.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.558 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 0.535 ' CB ' HG23 ' B' ' 388' ' ' VAL . 2.4 mm-40 -123.9 119.4 29.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.102 179.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.59 ' HB3' ' CZ ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -102.39 103.23 13.63 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.669 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.54 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.8 OUTLIER -142.68 170.44 15.7 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.125 -179.305 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.678 HG12 ' HG ' ' B' ' 385' ' ' LEU . 1.0 OUTLIER -148.57 177.69 0.88 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.547 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.515 -179.03 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 58.2 -102.84 0.28 Allowed Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 115.153 -0.93 . . . . 0.0 112.577 179.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -158.13 21.16 0.25 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.751 0.31 . . . . 0.0 110.842 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 170.99 31.95 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.667 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.54 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 99.3 m -124.31 111.68 16.1 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 121.05 -0.26 . . . . 0.0 110.983 179.519 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 58.2 t -103.61 107.43 22.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 178.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.564 ' HB3' ' HA ' ' B' ' 431' ' ' ALA . 0.0 OUTLIER -68.42 -26.11 65.37 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.633 -179.829 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . 0.464 ' O ' ' SG ' ' B' ' 404' ' ' CYS . . . 174.34 -177.22 46.61 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.874 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.443 ' O ' ' ND2' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -146.37 152.68 39.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.787 -0.206 . . . . 0.0 110.79 -179.832 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.437 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -149.53 158.06 27.5 Favored Glycine 0 C--O 1.227 -0.302 0 C-N-CA 119.757 -1.211 . . . . 0.0 113.647 -179.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . 0.418 ' HB ' HD12 ' B' ' 401' ' ' ILE . 1.4 p -141.4 151.41 19.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.528 -0.336 . . . . 0.0 110.779 179.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.817 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . -165.18 142.91 8.05 Favored Glycine 0 C--O 1.228 -0.265 0 C-N-CA 120.957 -0.639 . . . . 0.0 111.732 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.52 ' CG ' ' OD1' ' B' ' 419' ' ' ASN . 4.7 ptm180 -60.64 -43.77 97.18 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -179.059 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.726 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.1 OUTLIER -100.19 34.35 2.37 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 178.893 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.755 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 51.09 -46.39 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 N-CA-C 114.746 1.387 . . . . 0.0 114.746 179.328 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.577 ' N ' HD12 ' B' ' 420' ' ' ILE . 0.0 OUTLIER -43.96 -58.61 2.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 118.784 0.72 . . . . 0.0 109.768 -179.71 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.817 HD13 ' CA ' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -45.06 -19.84 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 177.261 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.755 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -88.0 -49.26 7.17 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 177.607 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . 0.464 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -58.8 -44.79 95.68 Favored Glycine 0 C--N 1.339 0.708 0 C-N-CA 119.914 -1.136 . . . . 0.0 110.775 178.538 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.457 HG13 ' OD2' ' B' ' 367' ' ' ASP . 2.4 mp -67.25 -64.86 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 178.055 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.601 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -40.41 -26.56 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.816 179.039 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.625 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -73.91 -55.28 6.36 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.529 179.428 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 0.935 ' CB ' ' HB1' ' B' ' 370' ' ' ALA . . . -50.7 -50.57 54.82 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.028 0.442 . . . . 0.0 110.203 179.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.792 ' HA ' HD22 ' B' ' 432' ' ' LEU . 0.6 OUTLIER -58.7 -66.15 0.54 Allowed 'General case' 0 C--O 1.218 -0.553 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 178.094 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.502 ' C ' ' O ' ' B' ' 429' ' ' GLU . 0.3 OUTLIER -24.83 -42.29 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.267 179.512 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.564 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -78.23 -39.12 41.31 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.286 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.832 HD23 ' C ' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -78.75 8.42 5.44 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.146 0.498 . . . . 0.0 111.576 179.812 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . 0.552 ' N ' HD23 ' B' ' 432' ' ' LEU . 0.1 OUTLIER -87.64 -5.25 58.8 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.516 -179.426 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.47 ' OD2' ' HB2' ' B' ' 437' ' ' MET . 54.1 t0 -107.02 90.77 3.4 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.843 0.354 . . . . 0.0 111.283 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.551 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.2 OUTLIER -51.62 -53.3 39.93 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.019 179.94 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.551 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.2 OUTLIER -54.52 -43.66 72.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.973 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.545 ' CE ' ' HG ' ' B' ' 412' ' ' LEU . 16.6 tmm? -69.86 -55.4 9.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.852 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.82 HD21 ' HA ' ' B' ' 432' ' ' LEU . 69.7 mt -52.81 -62.79 1.42 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.276 0.56 . . . . 0.0 110.337 179.471 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . 0.431 ' O ' ' N ' ' B' ' 442' ' ' ALA . 14.1 t0 -50.53 -47.27 57.61 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.244 -0.889 . . . . 0.0 108.924 178.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.477 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.5 OUTLIER -44.12 -41.16 5.44 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.264 179.565 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.627 ' HB3' HG23 ' B' ' 378' ' ' ILE . 43.2 m-85 -74.2 -31.83 62.81 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.436 179.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . 0.431 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -59.32 -61.94 2.25 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.01 -42.58 63.14 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 178.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.472 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -54.48 -56.19 21.27 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.547 -0.752 . . . . 0.0 109.691 178.685 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.477 ' HD3' ' CD1' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -46.43 -38.21 8.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.96 179.649 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -77.29 -40.19 45.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.765 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.842 -179.69 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 366' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.456 -0.129 0 CA-C-O 120.735 0.302 . . . . 0.0 111.1 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.535 ' O ' ' N ' ' B' ' 370' ' ' ALA . 4.8 t0 -57.58 -65.61 0.6 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.906 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.546 ' HA ' ' CE ' ' B' ' 371' ' ' LYS . 4.5 tmm? -36.86 -46.84 0.65 Allowed 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.338 0.589 . . . . 0.0 110.256 179.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -61.94 -40.71 96.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.684 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 1.006 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -63.79 -70.36 0.22 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.854 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.548 ' HG2' ' N ' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -35.67 -45.72 0.39 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.842 0.353 . . . . 0.0 110.294 -179.809 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.55 ' O ' ' CB ' ' B' ' 376' ' ' SER . 5.4 tmm_? -62.32 -39.78 94.17 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.861 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.766 HE22 HD22 ' B' ' 438' ' ' LEU . 4.3 tm0? -62.05 -58.4 7.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.281 0.562 . . . . 0.0 110.75 179.187 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 0.768 ' N ' HD23 ' B' ' 374' ' ' LEU . 0.9 OUTLIER -50.85 -70.39 0.09 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.992 -1.003 . . . . 0.0 113.136 -178.607 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . 0.551 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.0 m-85 -72.65 -49.92 28.58 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -177.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.55 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -65.61 -54.83 22.31 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -178.445 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.909 ' O ' HD13 ' B' ' 378' ' ' ILE . 3.3 tp -75.53 -26.43 58.05 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.909 HD13 ' O ' ' B' ' 377' ' ' LEU . 10.9 mm -125.18 -58.03 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.551 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -36.61 105.58 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.734 -0.746 . . . . 0.0 113.095 -179.302 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.758 ' CD2' HD12 ' B' ' 383' ' ' LEU . 18.1 p90 -119.58 171.48 8.34 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.758 0.313 . . . . 0.0 110.632 179.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . 0.526 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -62.9 104.42 0.55 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.087 -179.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 2.2 t 86.11 45.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.388 179.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.895 ' O ' HD23 ' B' ' 383' ' ' LEU . 6.3 tt -97.72 -33.62 11.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.596 179.584 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . 0.528 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 0.0 OUTLIER 65.53 62.14 0.67 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.914 179.857 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.839 ' HB2' HD22 ' B' ' 383' ' ' LEU . 1.6 tt -108.45 127.97 54.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.661 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . 0.697 ' N ' HD23 ' B' ' 385' ' ' LEU . 35.7 p-80 -154.8 156.79 36.89 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -179.275 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.621 ' OH ' HD13 ' B' ' 374' ' ' LEU . 3.6 m-85 -112.45 152.43 28.72 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 114.374 -1.285 . . . . 0.0 110.892 178.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . 0.988 HG23 ' HB3' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -135.51 135.14 51.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.712 179.613 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.4 m -95.22 127.13 41.03 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.457 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 0.982 HG23 HG23 ' B' ' 401' ' ' ILE . 31.6 m -131.8 157.85 43.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.198 -179.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.696 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 87.38 21.73 0.06 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.52 179.737 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.535 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER 0.98 116.83 0.0 OUTLIER Pre-proline 0 N--CA 1.472 0.663 0 O-C-N 124.001 0.813 . . . . 0.0 112.476 179.884 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.483 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 20.5 Cg_exo -61.78 162.73 20.84 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 122.472 2.115 . . . . 0.0 112.641 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . 0.504 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 0.7 OUTLIER -155.49 166.11 34.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.159 -179.815 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -82.52 8.92 10.39 Favored 'General case' 0 CA--C 1.527 0.089 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.45 178.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . 0.435 HG22 ' OG1' ' B' ' 394' ' ' THR . 19.1 m -129.61 11.0 2.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.655 0.74 . . . . 0.0 109.208 178.069 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . 0.414 ' H ' ' HD3' ' B' ' 398' ' ' PRO . 0.4 OUTLIER 168.68 60.07 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 114.605 -1.18 . . . . 0.0 109.297 -179.908 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.504 ' HA ' ' H ' ' B' ' 394' ' ' THR . 90.3 Cg_exo -43.99 -54.58 3.71 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.047 2.498 . . . . 0.0 112.759 -179.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.552 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.7 OUTLIER -25.27 132.06 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.989 -178.483 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . 0.471 ' HB2' ' HG3' ' B' ' 393' ' ' PRO . 4.5 t -137.94 152.84 49.36 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.795 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 0.982 HG23 HG23 ' B' ' 390' ' ' VAL . 0.3 OUTLIER -114.92 141.21 32.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.067 0.46 . . . . 0.0 111.201 -179.631 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.673 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -106.27 158.24 6.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.431 179.672 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 0.988 ' HB3' HG23 ' B' ' 388' ' ' VAL . 63.4 tt0 -125.47 114.41 18.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.884 179.249 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.614 ' HB3' ' CZ ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -99.8 103.31 14.93 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.278 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.59 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.1 OUTLIER -144.41 169.36 18.07 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.327 -179.25 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.662 HG11 ' HG ' ' B' ' 385' ' ' LEU . 0.9 OUTLIER -149.76 -177.25 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.336 -178.942 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . 0.514 ' N ' HG23 ' B' ' 406' ' ' VAL . . . 56.57 -104.52 0.38 Allowed Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.658 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -155.25 18.44 0.42 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.874 0.369 . . . . 0.0 110.936 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 169.32 33.55 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 121.001 -0.619 . . . . 0.0 112.284 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.59 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 1.2 m -120.07 111.72 18.24 Favored 'General case' 0 C--O 1.22 -0.498 0 O-C-N 123.0 -0.118 . . . . 0.0 110.756 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 57.8 t -105.14 104.18 16.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.65 0.262 . . . . 0.0 110.53 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.715 HD13 ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -62.33 -26.89 68.68 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 179.345 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . 0.479 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 172.44 -171.57 44.37 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.121 -1.037 . . . . 0.0 113.181 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.461 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -145.79 147.68 32.13 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.664 -0.268 . . . . 0.0 110.704 -179.671 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.529 ' HA2' ' HG2' ' B' ' 426' ' ' ARG . . . -140.72 150.36 21.64 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 119.9 -1.143 . . . . 0.0 112.936 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . 0.779 ' HB ' HD12 ' B' ' 401' ' ' ILE . 1.6 p -152.02 137.3 10.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.788 0.327 . . . . 0.0 111.355 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.942 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -149.74 177.36 27.93 Favored Glycine 0 C--O 1.226 -0.344 0 C-N-CA 120.856 -0.688 . . . . 0.0 111.962 179.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.496 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 4.4 ptt85 -85.5 -45.52 11.72 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -179.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.684 ' H ' HD11 ' B' ' 422' ' ' ILE . 14.8 t30 -98.85 39.68 1.25 Allowed 'General case' 0 C--O 1.223 -0.332 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.686 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 1.0 OUTLIER 46.34 -47.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 179.069 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.663 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -42.35 -58.22 2.28 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 118.378 0.536 . . . . 0.0 109.893 -179.081 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.942 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -46.69 -17.57 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.567 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.916 178.246 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.686 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -86.49 -49.84 7.29 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . 0.501 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -57.33 -46.48 91.75 Favored Glycine 0 C--N 1.34 0.774 0 C-N-CA 119.824 -1.179 . . . . 0.0 110.781 178.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.593 ' N ' HD12 ' B' ' 425' ' ' ILE . 1.3 mp -66.55 -65.0 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.068 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.615 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -39.7 -31.62 0.11 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.045 178.691 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.58 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -63.7 -59.88 4.02 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 1.006 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -58.95 -54.32 48.43 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 178.296 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.658 ' OE2' ' HB2' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -53.12 -18.09 1.97 Allowed 'General case' 0 C--N 1.334 -0.076 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.339 178.602 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.525 ' ND2' ' O ' ' B' ' 426' ' ' ARG . 0.7 OUTLIER -82.07 -36.39 27.7 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.311 178.985 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.507 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -71.15 -37.17 72.25 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -178.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.865 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -83.85 12.2 6.44 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.044 179.968 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -99.17 -8.98 24.34 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.389 -179.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.493 ' O ' ' HG ' ' B' ' 438' ' ' LEU . 29.8 t0 -108.68 87.36 2.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.068 0.461 . . . . 0.0 111.203 -179.602 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.568 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -53.0 -53.15 54.4 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.088 -179.963 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.568 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 7.5 mttm -52.15 -46.72 65.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.99 -179.597 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.479 ' O ' ' HB3' ' B' ' 440' ' ' PHE . 14.3 tmm? -68.4 -50.85 49.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.979 0.419 . . . . 0.0 110.338 179.476 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.865 HD11 ' HA ' ' B' ' 432' ' ' LEU . 58.3 mt -51.73 -62.37 1.67 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.546 179.419 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . 0.451 ' O ' ' HB3' ' B' ' 442' ' ' ALA . 48.9 t0 -57.37 -39.18 75.48 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.232 178.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.48 ' CD1' ' C ' ' B' ' 440' ' ' PHE . 0.0 OUTLIER -45.94 -49.76 15.43 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.189 179.497 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.475 ' HA ' ' HB2' ' B' ' 444' ' ' GLN . 60.8 m-85 -65.15 -37.42 87.34 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.504 179.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . 0.455 ' O ' ' N ' ' B' ' 445' ' ' ARG . . . -45.52 -62.07 1.43 Allowed 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 178.23 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -48.36 -47.66 37.07 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 178.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.475 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 2.5 mm100 -65.67 -5.7 9.23 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.046 178.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.536 ' HD3' ' CB ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -89.51 -42.25 11.57 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.1 179.79 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -71.46 -31.14 66.82 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.986 179.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.409 179.825 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 366' ' ' LEU . . . . . 0.792 HD12 ' H ' ' B' ' 367' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.455 -0.215 0 CA-C-O 120.71 0.29 . . . . 0.0 110.34 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.792 ' H ' HD12 ' B' ' 366' ' ' LEU . 30.0 t70 -41.93 -77.45 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.426 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.559 ' HA ' ' CD ' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -36.11 -41.72 0.27 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.52 179.414 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . 0.512 ' N ' ' HG3' ' B' ' 368' ' ' MET . 2.8 m-80 -63.96 -45.82 87.41 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.034 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 1.002 ' HB3' ' HB1' ' B' ' 428' ' ' ALA . . . -61.92 -68.53 0.31 Allowed 'General case' 0 C--O 1.223 -0.322 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 179.441 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.559 ' CD ' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -35.64 -44.89 0.34 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.795 0.331 . . . . 0.0 110.547 179.946 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.556 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.0 OUTLIER -64.64 -36.03 82.92 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-O 121.329 0.585 . . . . 0.0 110.247 179.209 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.963 ' O ' HG23 ' B' ' 378' ' ' ILE . 0.0 OUTLIER -62.51 -46.1 89.95 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.98 179.46 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 1.038 HD12 HD21 ' B' ' 385' ' ' LEU . 0.1 OUTLIER -71.71 -65.73 0.72 Allowed 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -178.126 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . 0.633 ' CE1' HD11 ' B' ' 385' ' ' LEU . 2.5 m-85 -78.96 -7.25 57.87 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.337 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.556 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.2 OUTLIER -128.2 4.13 5.79 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.851 0.686 . . . . 0.0 112.851 -179.12 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.846 HD23 ' CD ' ' B' ' 373' ' ' GLN . 49.4 tp -152.52 -2.74 0.25 Allowed 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -179.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.963 HG23 ' O ' ' B' ' 373' ' ' GLN . 0.7 OUTLIER -131.52 -51.93 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.101 0 C-N-CA 119.442 -0.903 . . . . 0.0 112.324 179.602 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.795 ' CA ' HD21 ' B' ' 383' ' ' LEU . . . -114.36 -151.45 10.36 Favored Glycine 0 N--CA 1.445 -0.765 0 C-N-CA 119.529 -1.32 . . . . 0.0 113.607 -179.117 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.481 ' CD1' ' C ' ' B' ' 379' ' ' GLY . 0.1 OUTLIER -155.09 -84.47 0.06 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.175 -0.513 . . . . 0.0 110.124 -179.389 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -170.59 25.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.692 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . 0.493 ' O ' ' HG2' ' B' ' 384' ' ' ARG . 0.1 OUTLIER -131.73 -43.71 0.99 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.668 0.27 . . . . 0.0 111.034 179.874 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.822 HD12 ' N ' ' B' ' 384' ' ' ARG . 1.1 pp -61.32 -15.01 31.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.949 0.404 . . . . 0.0 110.772 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . 0.822 ' N ' HD12 ' B' ' 383' ' ' LEU . 15.0 mmt180 70.1 66.93 0.22 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.693 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 1.038 HD21 HD12 ' B' ' 374' ' ' LEU . 0.0 OUTLIER -102.12 132.8 47.8 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.88 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . 0.986 ' N ' HD22 ' B' ' 385' ' ' LEU . 30.8 p-80 -176.31 -177.39 0.86 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.627 0.727 . . . . 0.0 112.684 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.564 ' CE2' ' HB3' ' B' ' 404' ' ' CYS . 2.6 m-85 -118.96 165.18 14.41 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-N 114.749 -1.114 . . . . 0.0 110.156 178.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . 0.531 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -149.62 112.3 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 CA-C-O 121.484 0.659 . . . . 0.0 112.047 179.388 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 13.2 m -72.76 130.01 39.51 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.974 179.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 0.828 HG23 HG23 ' B' ' 401' ' ' ILE . 29.6 m -136.96 153.22 29.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.985 -179.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.53 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 86.16 28.47 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.351 -179.406 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.507 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.8 OUTLIER -8.58 119.06 0.03 OUTLIER Pre-proline 0 N--CA 1.467 0.41 0 O-C-N 124.148 0.905 . . . . 0.0 112.587 -179.717 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.487 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 2.0 Cg_endo -49.09 167.68 0.13 Allowed 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.703 2.269 . . . . 0.0 112.591 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . 0.431 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 52.2 p -150.33 158.86 44.62 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.39 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -77.65 5.7 8.72 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 120.962 0.41 . . . . 0.0 111.139 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 15.2 m -133.22 12.98 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.535 0.683 . . . . 0.0 109.387 178.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 174.22 56.93 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.004 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.51 ' O ' ' C ' ' B' ' 399' ' ' ASN . 60.0 Cg_exo -35.72 -57.1 0.54 Allowed 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 123.081 2.52 . . . . 0.0 112.71 -179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.553 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 2.0 m-20 -13.52 125.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.924 -179.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 38.7 t -132.33 142.37 49.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.781 179.199 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 0.828 HG23 HG23 ' B' ' 390' ' ' VAL . 0.1 OUTLIER -109.6 134.13 52.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-O 121.104 0.478 . . . . 0.0 111.328 -179.366 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.908 HG21 ' O ' ' B' ' 423' ' ' ALA . 2.0 t -98.16 154.73 3.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.76 179.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 0.531 ' CB ' HG23 ' B' ' 388' ' ' VAL . 8.4 mm-40 -130.7 104.29 7.1 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.367 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.564 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -92.5 107.22 19.05 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.659 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.521 ' HA ' ' O ' ' B' ' 410' ' ' THR . 10.5 ptm180 -147.21 164.95 31.52 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.894 -179.423 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.6 HG12 ' HA ' ' B' ' 385' ' ' LEU . 1.6 m -144.2 144.44 22.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.01 -179.544 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 68.56 3.86 35.66 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.42 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 67.11 12.31 8.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.704 0.288 . . . . 0.0 110.799 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -133.68 -5.19 2.91 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.474 -0.869 . . . . 0.0 113.239 -179.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.521 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 63.8 m -130.06 122.98 29.4 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-N 116.992 0.396 . . . . 0.0 111.935 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 9.6 t -107.26 96.07 4.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.834 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.554 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -54.53 -21.86 11.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.011 0.434 . . . . 0.0 110.301 179.648 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 160.12 -161.51 32.52 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.69 -0.766 . . . . 0.0 112.299 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . 0.504 ' OG1' HD11 ' B' ' 401' ' ' ILE . 8.8 t -160.25 167.68 27.03 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.121 0.486 . . . . 0.0 111.471 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.51 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -141.3 154.61 24.69 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.654 -0.784 . . . . 0.0 113.582 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . 0.773 ' CG2' HD12 ' B' ' 401' ' ' ILE . 85.9 t -148.15 100.86 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 120.761 0.315 . . . . 0.0 110.777 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.957 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -113.95 162.53 12.36 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.626 -0.797 . . . . 0.0 111.768 179.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.425 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.0 OUTLIER -83.38 -50.68 8.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 117.125 0.462 . . . . 0.0 111.027 179.994 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.952 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.5 OUTLIER -80.01 -23.93 41.17 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 120.972 -0.291 . . . . 0.0 110.767 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.952 HG23 ' O ' ' B' ' 419' ' ' ASN . 1.2 pp 110.54 -39.77 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 124.523 1.129 . . . . 0.0 110.842 -179.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.558 ' N ' HD12 ' B' ' 420' ' ' ILE . 0.3 OUTLIER -45.86 -63.08 1.06 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.994 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.957 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -45.34 -24.45 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.282 177.316 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.908 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -72.75 -51.76 17.81 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.092 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . 0.501 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -64.0 -54.6 29.41 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.25 -0.976 . . . . 0.0 111.322 179.341 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.655 ' N ' HD13 ' B' ' 425' ' ' ILE . 2.1 mm -62.6 -71.08 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.575 0 CA-C-N 115.662 -0.269 . . . . 0.0 111.113 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.539 ' CG ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -46.34 -25.4 0.63 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.944 0.402 . . . . 0.0 110.83 -178.549 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.702 ' HB2' ' O ' ' B' ' 423' ' ' ALA . . . -62.56 -54.58 37.64 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 176.576 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 1.002 ' HB1' ' HB3' ' B' ' 370' ' ' ALA . . . -53.59 -50.84 64.76 Favored 'General case' 0 C--O 1.243 0.753 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 177.62 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.508 ' HA ' ' CD1' ' B' ' 432' ' ' LEU . 29.2 mt-10 -61.38 -8.54 4.08 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 115.085 -0.962 . . . . 0.0 111.402 179.168 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.537 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 24.8 m120 -86.48 -39.6 16.12 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.537 178.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.561 ' CB ' ' OH ' ' B' ' 387' ' ' TYR . . . -70.87 -34.39 71.56 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 -179.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.722 ' CD1' ' HB2' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -85.82 14.51 5.86 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.383 -0.527 . . . . 0.0 111.356 -179.897 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 8.2 ttt180 -94.89 -3.71 48.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.178 -179.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.548 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 18.2 m-20 -113.59 73.1 0.8 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.328 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.555 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 6.5 ptmt -41.89 -52.65 4.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.856 0.36 . . . . 0.0 110.579 179.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.555 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 1.4 mtpp -55.87 -45.17 78.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.212 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.554 ' SD ' HD12 ' B' ' 412' ' ' LEU . 15.5 tmm? -65.82 -52.3 51.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.082 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.941 HD22 ' NE2' ' B' ' 373' ' ' GLN . 24.3 mt -53.62 -65.37 0.58 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.617 179.297 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -46.51 -49.09 18.99 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.731 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.534 ' CE2' ' CZ ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -48.37 -42.23 31.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.532 0.682 . . . . 0.0 109.377 179.999 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.589 ' CB ' ' HB ' ' B' ' 378' ' ' ILE . 45.4 m-85 -73.02 -37.88 66.76 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.2 179.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -51.7 -59.47 4.25 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 3.4 ttmt -49.08 -45.24 42.82 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.504 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -54.11 -49.04 70.04 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.058 178.543 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.72 -27.71 63.21 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.048 179.786 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -74.83 -41.61 59.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.976 0.417 . . . . 0.0 110.509 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.124 -179.933 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 366' ' ' LEU . . . . . 0.513 ' O ' ' HB2' ' B' ' 369' ' ' ASN . 6.7 tp . . . . . 0 N--CA 1.452 -0.326 0 CA-C-O 121.157 0.503 . . . . 0.0 110.982 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 367' ' ' ASP . . . . . 0.479 ' HB3' HG13 ' B' ' 425' ' ' ILE . 1.0 OUTLIER -46.84 -72.86 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 179.133 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 368' ' ' MET . . . . . 0.545 ' HE3' ' N ' ' B' ' 369' ' ' ASN . 3.5 tmm? -34.41 -42.48 0.14 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.773 179.591 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 369' ' ' ASN . . . . . 0.545 ' N ' ' HE3' ' B' ' 368' ' ' MET . 90.7 m-20 -59.99 -50.5 73.49 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.8 0.333 . . . . 0.0 110.704 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 370' ' ' ALA . . . . . 0.71 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -56.38 -68.31 0.22 Allowed 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 178.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 371' ' ' LYS . . . . . 0.425 ' C ' ' O ' ' B' ' 370' ' ' ALA . 2.5 mttm -33.85 -51.3 0.4 Allowed 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.9 179.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 372' ' ' ARG . . . . . 0.591 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.2 OUTLIER -56.64 -38.33 71.98 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.712 -179.843 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 373' ' ' GLN . . . . . 0.56 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -62.87 -57.14 11.85 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.696 0.76 . . . . 0.0 110.159 178.955 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 374' ' ' LEU . . . . . 1.091 HD11 ' CB ' ' B' ' 428' ' ' ALA . 1.8 mt -48.8 -74.75 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 1.5 m-30 -98.14 4.39 49.05 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 -176.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 376' ' ' SER . . . . . 0.591 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.1 OUTLIER -116.2 -2.04 12.26 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.077 0.465 . . . . 0.0 110.211 178.705 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 377' ' ' LEU . . . . . 0.544 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.4 OUTLIER -133.42 -39.04 0.92 Allowed 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.082 177.901 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 378' ' ' ILE . . . . . 0.436 ' C ' ' O ' ' B' ' 374' ' ' LEU . 0.7 OUTLIER -127.15 -142.79 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.672 179.501 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 379' ' ' GLY . . . . . 0.51 ' O ' ' O ' ' B' ' 380' ' ' TYR . . . 93.26 -22.62 33.85 Favored Glycine 0 C--N 1.332 0.342 0 C-N-CA 120.535 -0.84 . . . . 0.0 113.139 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 380' ' ' TYR . . . . . 0.633 ' CD2' ' HB3' ' B' ' 383' ' ' LEU . 0.2 OUTLIER 36.93 -175.23 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 115.258 1.577 . . . . 0.0 115.258 179.57 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -123.42 -21.46 5.31 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 113.734 -1.575 . . . . 0.0 111.183 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 37.9 t -160.14 44.84 0.22 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.136 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 383' ' ' LEU . . . . . 0.818 HD13 ' C ' ' B' ' 383' ' ' LEU . 0.0 OUTLIER -114.05 -3.99 13.24 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.861 0.362 . . . . 0.0 111.018 178.749 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 384' ' ' ARG . . . . . 0.777 ' N ' HD13 ' B' ' 383' ' ' LEU . 11.9 tpt180 75.86 71.63 0.08 Allowed 'General case' 0 C--O 1.227 -0.127 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 178.327 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 385' ' ' LEU . . . . . 0.661 ' HB2' HD11 ' B' ' 383' ' ' LEU . 7.3 tt -135.32 123.88 23.57 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.451 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 386' ' ' HIS . . . . . 0.492 ' N ' HD23 ' B' ' 385' ' ' LEU . 7.5 p-80 -158.91 146.17 17.47 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 -178.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 387' ' ' TYR . . . . . 0.745 ' CZ ' HD13 ' B' ' 374' ' ' LEU . 39.2 m-85 -96.56 132.77 41.82 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 114.095 -1.411 . . . . 0.0 110.823 178.172 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -122.17 130.82 74.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.52 179.575 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.1 m -91.96 121.17 33.3 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.291 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 390' ' ' VAL . . . . . 1.01 HG23 HG23 ' B' ' 401' ' ' ILE . 27.5 m -128.9 152.35 36.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.309 -179.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 391' ' ' LYS . . . . . 0.65 ' HB2' HG22 ' B' ' 401' ' ' ILE . 4.7 tmtt? 87.66 24.87 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.311 179.572 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 392' ' ' LYS . . . . . 0.542 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.2 OUTLIER -4.72 116.95 0.02 OUTLIER Pre-proline 0 N--CA 1.473 0.696 0 O-C-N 124.016 0.822 . . . . 0.0 111.962 -179.964 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 393' ' ' PRO . . . . . 0.554 ' CG ' HG21 ' B' ' 420' ' ' ILE . 15.7 Cg_exo -65.35 162.03 35.31 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.351 2.034 . . . . 0.0 112.542 -179.345 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . 0.456 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 2.3 p -150.08 164.82 34.56 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.478 -0.783 . . . . 0.0 112.022 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -81.6 5.29 18.57 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.603 179.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 396' ' ' VAL . . . . . 0.591 HG23 ' OD2' ' B' ' 397' ' ' ASP . 26.1 m -123.41 11.54 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 CA-C-O 121.53 0.681 . . . . 0.0 109.462 178.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 397' ' ' ASP . . . . . 0.591 ' OD2' HG23 ' B' ' 396' ' ' VAL . 2.0 p30 163.95 59.33 0.0 OUTLIER Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 114.803 -1.089 . . . . 0.0 109.841 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 398' ' ' PRO . . . . . 0.541 ' HB2' ' O ' ' B' ' 418' ' ' ARG . 21.5 Cg_exo -32.91 -57.4 0.31 Allowed 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 123.069 2.513 . . . . 0.0 112.368 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 399' ' ' ASN . . . . . 0.52 ' C ' ' O ' ' B' ' 398' ' ' PRO . 15.7 m120 -5.23 120.77 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 114.948 -1.023 . . . . 0.0 112.256 179.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 400' ' ' SER . . . . . 0.512 ' CB ' ' HG3' ' B' ' 393' ' ' PRO . 0.3 OUTLIER -144.15 139.4 28.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.886 179.949 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 401' ' ' ILE . . . . . 1.01 HG23 HG23 ' B' ' 390' ' ' VAL . 1.9 tp -110.34 143.46 20.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.717 -179.537 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 402' ' ' VAL . . . . . 0.68 ' HB ' ' HB2' ' B' ' 427' ' ' ALA . 0.4 OUTLIER -112.78 148.99 15.41 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.651 -179.568 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 403' ' ' GLU . . . . . 0.517 ' OE1' HG11 ' B' ' 411' ' ' VAL . 2.1 mm-40 -127.74 128.72 45.86 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.745 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 404' ' ' CYS . . . . . 0.606 ' HB3' ' HA3' ' B' ' 413' ' ' GLY . 18.7 t -118.85 104.86 10.94 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 177.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.571 ' HB2' HG22 ' B' ' 411' ' ' VAL . 3.1 ttp180 -110.96 158.2 19.03 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 124.126 0.891 . . . . 0.0 111.666 -178.3 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 406' ' ' VAL . . . . . 0.683 HG23 ' HB ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -154.7 159.62 3.0 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.668 -179.6 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 64.93 -94.82 0.18 Allowed Glycine 0 CA--C 1.518 0.259 0 CA-C-N 115.173 -0.921 . . . . 0.0 113.211 179.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -141.61 20.55 2.19 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 111.555 0.206 . . . . 0.0 111.555 -179.392 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 151.82 -14.46 0.79 Allowed Glycine 0 C--N 1.33 0.195 0 C-N-CA 120.234 -0.984 . . . . 0.0 112.96 179.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 410' ' ' THR . . . . . 0.683 ' HB ' HG23 ' B' ' 406' ' ' VAL . 95.0 m -53.58 108.77 0.37 Allowed 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 411' ' ' VAL . . . . . 0.571 HG22 ' HB2' ' B' ' 405' ' ' ARG . 24.2 t -124.07 106.61 17.21 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.742 0 CA-C-O 122.006 0.908 . . . . 0.0 111.523 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.461 ' O ' ' HB3' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -102.62 -38.99 7.26 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 113.704 -1.589 . . . . 0.0 108.942 -179.878 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 413' ' ' GLY . . . . . 0.606 ' HA3' ' HB3' ' B' ' 404' ' ' CYS . . . -72.23 98.64 0.82 Allowed Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.069 -1.062 . . . . 0.0 112.535 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 414' ' ' THR . . . . . . . . . . . . . 3.7 m -134.79 93.68 3.06 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 415' ' ' GLY . . . . . 0.804 ' O ' HD12 ' B' ' 401' ' ' ILE . . . -133.71 147.3 18.99 Favored Glycine 0 C--O 1.226 -0.363 0 C-N-CA 119.523 -1.322 . . . . 0.0 114.394 -178.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 10.5 p -127.87 154.1 38.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.312 -0.444 . . . . 0.0 110.173 179.566 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.873 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -165.1 155.72 27.27 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 119.948 -1.12 . . . . 0.0 113.039 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 418' ' ' ARG . . . . . 0.541 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.0 OUTLIER -70.77 -41.98 71.0 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.867 0.365 . . . . 0.0 111.361 -179.939 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 419' ' ' ASN . . . . . 0.808 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.1 OUTLIER -100.36 23.97 9.46 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.184 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 420' ' ' ILE . . . . . 0.759 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 56.51 -43.09 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 179.247 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 421' ' ' LYS . . . . . 0.626 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -45.17 -57.71 3.74 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 179.282 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 422' ' ' ILE . . . . . 0.873 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -45.78 -26.76 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.56 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.601 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.759 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -77.26 -47.92 18.85 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 177.233 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 424' ' ' GLY . . . . . 0.59 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -57.89 -53.48 45.02 Favored Glycine 0 N--CA 1.447 -0.58 0 N-CA-C 110.058 -1.217 . . . . 0.0 110.058 178.079 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 425' ' ' ILE . . . . . 0.479 HG13 ' HB3' ' B' ' 367' ' ' ASP . 0.7 OUTLIER -59.15 -67.67 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 177.653 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 426' ' ' ARG . . . . . 0.567 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 3.5 tpt180 -35.86 -33.76 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.201 179.213 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 427' ' ' ALA . . . . . 0.68 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -63.33 -58.17 7.98 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.512 178.478 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 428' ' ' ALA . . . . . 1.091 ' CB ' HD11 ' B' ' 374' ' ' LEU . . . -58.25 -53.87 53.35 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 178.476 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 429' ' ' GLU . . . . . 0.542 ' HA ' HD21 ' B' ' 432' ' ' LEU . 1.1 tt0 -49.14 -25.02 1.9 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.365 178.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 430' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 2.4 m-80 -78.34 -36.89 45.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.477 179.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 431' ' ' ALA . . . . . 0.497 ' O ' ' CE ' ' B' ' 437' ' ' MET . . . -67.73 -41.77 82.94 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.487 -179.372 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 432' ' ' LEU . . . . . 0.827 ' HA ' HD21 ' B' ' 438' ' ' LEU . 0.6 OUTLIER -81.05 6.88 12.24 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.041 -179.839 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.47 -10.75 59.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.711 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 434' ' ' ASP . . . . . 0.501 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 0.8 OUTLIER -126.25 89.95 3.1 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.609 -0.437 . . . . 0.0 112.009 -178.991 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 435' ' ' LYS . . . . . 0.599 ' HA ' HD12 ' B' ' 438' ' ' LEU . 12.4 ptmt -53.79 -51.36 63.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.2 179.198 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 436' ' ' LYS . . . . . 0.561 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -51.95 -36.23 48.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.144 179.834 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 437' ' ' MET . . . . . 0.501 ' HB3' ' HB3' ' B' ' 434' ' ' ASP . 14.9 tmm? -76.75 -50.47 13.5 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.944 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 438' ' ' LEU . . . . . 0.827 HD21 ' HA ' ' B' ' 432' ' ' LEU . 23.0 mt -53.02 -64.04 0.95 Allowed 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.735 0.779 . . . . 0.0 110.162 178.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 439' ' ' ASP . . . . . 0.525 ' O ' ' N ' ' B' ' 442' ' ' ALA . 6.1 t70 -50.55 -50.04 54.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.736 179.11 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 440' ' ' PHE . . . . . 0.43 ' HB3' ' O ' ' B' ' 436' ' ' LYS . 0.1 OUTLIER -43.03 -38.58 2.35 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.777 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 441' ' ' TYR . . . . . 0.526 ' O ' ' CG ' ' B' ' 444' ' ' GLN . 48.1 m-85 -74.33 -31.43 62.44 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.863 179.456 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 442' ' ' ALA . . . . . 0.525 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -59.01 -60.65 3.53 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 177.451 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.9 -37.47 19.84 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 178.104 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 444' ' ' GLN . . . . . 0.662 ' HG3' ' N ' ' B' ' 445' ' ' ARG . 0.0 OUTLIER -62.17 -47.14 85.82 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.384 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 445' ' ' ARG . . . . . 0.662 ' N ' ' HG3' ' B' ' 444' ' ' GLN . 0.0 OUTLIER -50.06 -35.1 23.77 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.083 179.589 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -86.63 -39.95 15.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.481 -179.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.912 -179.275 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.509 " O2'" " O5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.183 0 O4'-C1'-N19 111.397 3.197 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.597 ' C6 ' ' C5 ' ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.222 0 O4'-C1'-N19 110.982 2.782 . 0.062 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.81 HO2' " C5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.714 0 C3'-C2'-C1' 104.838 3.709 . 0.048 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.81 " C5'" HO2' ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.068 0 O4'-C1'-N19 111.298 3.098 . 0.103 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.5 ' C6 ' " H2'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.189 0 O4'-C1'-N19 111.162 2.962 . 0.091 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.538 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.218 0 O4'-C1'-N19 111.294 3.094 . 0.218 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.673 ' H6 ' " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.993 0 O4'-C1'-N19 111.313 3.113 . 0.373 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.549 ' N4 ' ' C4 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.286 0 O4'-C1'-N19 110.971 2.771 . 0.241 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.455 " H2'" ' C6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.19 0 O4'-C1'-N19 111.249 3.049 . 0.087 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.642 " O2'" " C5'" ' A' ' 11' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.438 1.97 0 O4'-C1'-N19 111.124 2.924 . 0.369 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.642 " C5'" " O2'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.303 0 O4'-C1'-N19 111.114 2.914 . 0.076 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.781 " O5'" ' H6 ' ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.436 1.802 0 O4'-C1'-N19 111.147 2.947 . 0.017 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.781 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.169 0 O4'-C1'-N19 111.6 3.4 . 0.023 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.705 ' C5 ' ' C8 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -2.041 0 C5'-C4'-C3' 111.191 -2.873 . 0.064 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.705 ' C8 ' ' C5 ' ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.429 -2.033 0 C5'-C4'-C3' 110.685 -3.21 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.7 ' C8 ' ' C6 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.433 -1.65 0 C5'-C4'-C3' 110.762 -3.158 . 0.35 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.567 " O2'" " O4'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.43 -1.887 0 C5'-C4'-C3' 111.16 -2.893 . 0.0 OUTLIER alpha 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.737 " H2'" " O4'" ' A' ' 19' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.435 1.73 0 C5'-C4'-C3' 110.881 -3.079 . 0.079 2a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.737 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.281 0 O4'-C1'-N19 111.222 3.022 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.868 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 P--O5' 1.609 1.647 0 C5'-C4'-C3' 110.925 -3.05 . 0.264 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.868 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.685 0 C3'-C2'-C1' 104.603 3.448 . 0.012 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.931 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.436 1.852 0 O4'-C1'-N19 111.228 3.028 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.82 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.145 0 C5'-C4'-C3' 111.333 -2.778 . 0.031 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.69 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.36 0 O4'-C1'-N19 111.453 3.253 . 0.185 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . 0.575 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.301 0 O4'-C1'-N19 111.066 2.866 . 0.178 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.575 ' C6 ' ' C6 ' ' A' ' 25' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.569 0 O4'-C1'-N19 111.097 2.897 . 0.117 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.865 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.024 0 O4'-C1'-N19 111.146 2.946 . 0.113 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.865 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.532 0 C3'-C2'-C1' 104.401 3.223 . 0.028 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.916 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.196 0 O4'-C1'-N19 111.254 3.054 . 0.176 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 0.992 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.356 0 O4'-C1'-N19 111.533 3.333 . 0.29 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 0.992 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.597 0 O4'-C1'-N19 111.265 3.065 . 0.202 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . 0.638 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.538 0 C5'-C4'-C3' 111.077 -2.949 . 0.133 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.152 0 N-CA-C 112.547 -0.221 . . . . 0.0 112.547 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -142.17 78.31 1.62 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.769 0.319 . . . . 0.0 110.885 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . 0.815 ' O ' HD23 ' B' ' 366' ' ' LEU . 0.3 OUTLIER -159.81 159.92 33.2 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.44 0.533 . . . . 0.0 112.44 179.942 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.479 ' O ' ' HG2' ' B' ' 371' ' ' LYS . 21.1 t70 26.12 -96.6 0.01 OUTLIER 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.344 -179.3 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.575 ' CE ' ' ND2' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -41.7 -56.24 2.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.578 -0.283 . . . . 0.0 110.553 179.773 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . 0.575 ' ND2' ' CE ' ' B' ' 368' ' ' MET . 3.1 m-80 -62.97 -34.39 77.41 Favored 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 1.021 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -62.59 -72.15 0.14 Allowed 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.852 179.176 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.479 ' HG2' ' O ' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -39.15 -38.18 0.46 Allowed 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.648 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.642 ' CG ' ' N3 ' ' A' ' 18' ' ' ' A' . 0.6 OUTLIER -61.83 -46.47 89.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.234 179.259 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.514 ' HG3' ' HB2' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -60.98 -59.57 5.16 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.617 179.315 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 0.572 HD23 ' N ' ' B' ' 374' ' ' LEU . 0.7 OUTLIER -46.36 -69.97 0.11 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.109 -0.951 . . . . 0.0 112.025 -179.464 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . 0.523 ' O ' ' N ' ' B' ' 379' ' ' GLY . 1.9 m-85 -72.03 -61.16 1.89 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -177.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.529 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.6 OUTLIER -55.58 -56.88 15.2 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -178.478 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.498 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.2 OUTLIER -72.2 -45.51 60.02 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 112.889 0.7 . . . . 0.0 112.889 -178.273 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.78 HG22 HD11 ' B' ' 383' ' ' LEU . 11.3 mm -128.5 39.1 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.317 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' B' ' 375' ' ' TYR . . . -111.21 73.49 0.21 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.415 179.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.862 ' CD1' HD12 ' B' ' 383' ' ' LEU . 23.8 p90 -95.01 -164.64 1.19 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.669 0.271 . . . . 0.0 110.865 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . 0.575 ' O ' ' CE2' ' B' ' 380' ' ' TYR . . . -97.53 124.54 41.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.369 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . 0.57 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 1.5 m 94.33 -10.93 0.12 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.97 179.253 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.862 HD12 ' CD1' ' B' ' 380' ' ' TYR . 5.1 tt -45.49 -39.99 7.9 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.112 0.482 . . . . 0.0 110.532 179.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 13.9 tpt85 67.33 64.76 0.42 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.929 179.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.561 ' HA ' HG12 ' B' ' 406' ' ' VAL . 0.1 OUTLIER -58.45 157.46 8.82 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.347 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . 0.525 ' CB ' ' O ' ' B' ' 405' ' ' ARG . 0.0 OUTLIER -158.67 72.65 0.6 Allowed 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 114.419 1.266 . . . . 0.0 114.419 -178.822 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.578 ' CZ ' ' HB3' ' B' ' 404' ' ' CYS . 5.7 m-85 -86.67 95.56 9.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.849 0.357 . . . . 0.0 110.089 177.135 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . 0.567 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -88.66 136.88 22.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.028 -179.7 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.2 m -97.12 126.43 42.29 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.943 -0.572 . . . . 0.0 110.084 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 0.965 HG23 HG23 ' B' ' 401' ' ' ILE . 28.0 m -132.33 153.21 37.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.5 -179.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.545 ' O ' ' C ' ' B' ' 392' ' ' LYS . 6.6 tptt 87.3 21.87 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.501 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.545 ' C ' ' O ' ' B' ' 391' ' ' LYS . 6.7 mttp -8.72 122.41 0.02 OUTLIER Pre-proline 0 N--CA 1.472 0.647 0 O-C-N 123.839 0.712 . . . . 0.0 111.996 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.514 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 23.9 Cg_exo -62.83 163.04 23.17 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.787 2.325 . . . . 0.0 113.447 -178.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . 0.625 ' OG1' HG22 ' B' ' 396' ' ' VAL . 0.1 OUTLIER -149.65 168.0 24.82 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.337 179.832 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -81.12 7.68 10.49 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-O 120.973 0.416 . . . . 0.0 111.159 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . 0.625 HG22 ' OG1' ' B' ' 394' ' ' THR . 5.2 m -129.26 13.59 2.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.425 0.631 . . . . 0.0 109.613 178.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . 0.523 ' OD1' ' CG2' ' B' ' 394' ' ' THR . 10.5 p30 163.51 63.12 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.382 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.528 ' O ' ' C ' ' B' ' 399' ' ' ASN . 75.9 Cg_exo -39.06 -51.35 2.5 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.852 2.368 . . . . 0.0 112.028 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.528 ' C ' ' O ' ' B' ' 398' ' ' PRO . 10.2 m120 -6.75 123.36 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.027 -0.988 . . . . 0.0 112.385 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . 0.498 ' HB3' HG22 ' B' ' 420' ' ' ILE . 0.9 OUTLIER -140.49 137.97 34.25 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.581 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 0.965 HG23 HG23 ' B' ' 390' ' ' VAL . 0.5 OUTLIER -114.26 141.73 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 CA-C-O 120.995 0.426 . . . . 0.0 111.18 -179.769 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.602 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.3 OUTLIER -107.87 152.41 9.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.277 -179.178 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 0.567 ' CB ' HG23 ' B' ' 388' ' ' VAL . 0.1 OUTLIER -115.63 98.91 6.97 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.217 178.931 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.655 ' O ' HD22 ' B' ' 412' ' ' LEU . 0.0 OUTLIER -78.43 92.32 4.59 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 179.325 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.594 ' HA ' ' O ' ' B' ' 410' ' ' THR . 5.7 ptp180 -139.14 157.45 45.93 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.498 -179.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.622 HG13 HD21 ' B' ' 412' ' ' LEU . 2.9 m -148.98 158.86 6.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.826 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 73.62 -1.61 43.96 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.82 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 14.6 t0 76.42 7.97 3.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.695 0.283 . . . . 0.0 111.246 179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -157.76 17.61 0.34 Allowed Glycine 0 CA--C 1.519 0.338 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.92 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.753 HG21 ' OH ' ' B' ' 441' ' ' TYR . 0.2 OUTLIER -128.74 122.48 30.74 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 116.54 0.17 . . . . 0.0 111.044 179.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 36.0 t -113.21 103.45 15.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.602 0.239 . . . . 0.0 110.788 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.82 HD13 ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -67.79 -25.22 65.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.959 0.409 . . . . 0.0 110.024 179.546 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . 0.443 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 165.59 -165.36 37.89 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.313 -0.946 . . . . 0.0 112.843 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.473 ' CG2' ' O ' ' B' ' 402' ' ' VAL . 0.2 OUTLIER -150.68 157.41 42.93 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.657 0.265 . . . . 0.0 110.726 -179.766 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.498 ' HA2' ' HG2' ' B' ' 426' ' ' ARG . . . -149.73 152.29 24.26 Favored Glycine 0 C--O 1.226 -0.396 0 C-N-CA 120.044 -1.074 . . . . 0.0 113.226 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . 0.573 ' HB ' HD12 ' B' ' 401' ' ' ILE . 2.7 p -141.4 150.23 19.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.63 0.252 . . . . 0.0 110.898 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.876 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -163.0 161.34 33.81 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 120.445 -0.883 . . . . 0.0 112.608 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.493 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.0 OUTLIER -74.92 -42.86 56.93 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 120.807 0.337 . . . . 0.0 111.31 -179.787 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.753 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.7 OUTLIER -98.06 27.32 4.63 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 178.778 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.721 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 53.44 -44.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 178.903 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.648 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.6 OUTLIER -44.65 -56.8 4.09 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.975 -1.121 . . . . 0.0 107.975 179.867 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.876 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -46.29 -24.96 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.462 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 178.349 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.721 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -79.5 -48.74 13.38 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 177.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . 0.647 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -58.65 -52.82 50.78 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.284 -1.126 . . . . 0.0 110.284 178.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.518 HD13 ' N ' ' B' ' 425' ' ' ILE . 3.3 mm -58.43 -67.22 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 177.638 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.58 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 7.6 tpt180 -36.32 -32.16 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.237 178.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.647 ' HB3' ' O ' ' B' ' 424' ' ' GLY . . . -64.5 -55.13 22.7 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.431 178.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 1.021 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -56.88 -55.7 31.11 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.44 178.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.663 ' HA ' HD21 ' B' ' 432' ' ' LEU . 0.7 OUTLIER -53.5 -21.3 6.05 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.45 179.148 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.516 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.7 OUTLIER -75.65 -41.32 54.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.257 179.03 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.592 ' O ' HD21 ' B' ' 438' ' ' LEU . . . -67.25 -37.72 83.99 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.753 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.803 HD22 ' HA ' ' B' ' 370' ' ' ALA . 0.7 OUTLIER -83.9 9.57 11.83 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.716 0.293 . . . . 0.0 111.108 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -92.27 -11.72 34.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.245 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.526 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 32.7 m-20 -109.25 71.71 0.78 Allowed 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 120.687 0.279 . . . . 0.0 111.219 -179.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.57 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -45.84 -54.01 8.79 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.433 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.57 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 7.5 mttt -48.19 -40.46 24.2 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.57 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.674 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.4 OUTLIER -77.73 -41.03 39.15 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 178.973 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.592 HD21 ' O ' ' B' ' 431' ' ' ALA . 95.7 mt -56.17 -65.04 0.67 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.966 179.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . 0.494 ' O ' ' N ' ' B' ' 442' ' ' ALA . 21.5 t70 -55.92 -46.42 78.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.267 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.497 ' HB2' ' O ' ' B' ' 436' ' ' LYS . 8.2 t80 -41.97 -45.12 3.71 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 115.28 -0.873 . . . . 0.0 108.903 179.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.753 ' OH ' HG21 ' B' ' 410' ' ' THR . 16.6 m-30 -67.62 -37.56 82.67 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.487 178.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . 0.494 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -47.61 -61.77 1.77 Allowed 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 178.285 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.83 -57.34 11.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.78 -0.646 . . . . 0.0 109.643 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.439 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -41.92 -62.88 0.82 Allowed 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.232 0.539 . . . . 0.0 110.36 179.011 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.602 ' HG2' ' CD1' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -43.22 -37.35 2.1 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.819 179.172 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -76.74 -41.05 46.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.919 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . 0.47 ' O ' ' O ' ' B' ' 448' ' ' ILE . . . -70.31 -72.07 0.22 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.322 -179.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.495 HD11 ' O ' ' B' ' 445' ' ' ARG . 0.1 OUTLIER 27.87 100.23 0.02 OUTLIER Pre-proline 0 N--CA 1.463 0.181 0 CA-C-N 116.031 -0.531 . . . . 0.0 112.029 -179.82 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -71.57 -169.05 0.39 Allowed 'Trans proline' 0 N--CA 1.464 -0.242 0 C-N-CA 122.912 2.408 . . . . 0.0 112.43 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 2.9 mmp_? -90.31 172.63 8.63 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.181 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 23.8 m 60.33 67.3 0.86 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.154 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -126.95 141.32 51.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.635 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 6.2 p . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.265 -0.874 . . . . 0.0 111.033 -179.791 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.762 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.436 1.837 0 C5'-C4'-C3' 111.19 -2.874 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.88 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.193 0 O4'-C1'-N19 111.345 3.145 . 0.326 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.88 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.175 0 O4'-C1'-N19 111.042 2.842 . 0.286 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.638 " C5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.271 0 C5'-C4'-C3' 111.229 -2.848 . 0.079 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.518 ' C6 ' " H2'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.217 0 O4'-C1'-N19 111.266 3.066 . 0.203 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.492 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.239 0 O4'-C1'-N19 111.065 2.865 . 0.153 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.519 ' H6 ' " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.002 0 O4'-C1'-N19 111.504 3.304 . 0.169 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.632 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.442 2.312 0 O4'-C1'-N19 111.093 2.893 . 0.234 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.632 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.436 0 O4'-C1'-N19 111.111 2.911 . 0.305 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.595 ' H6 ' " O5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.437 1.902 0 O4'-C1'-N19 111.338 3.138 . 0.063 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.647 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.426 0 O4'-C1'-N19 111.05 2.85 . 0.058 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.875 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 P--O5' 1.612 1.863 0 C5'-C4'-C3' 111.19 -2.873 . 0.02 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.875 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.578 0 C3'-C2'-C1' 104.67 3.522 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.643 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.491 0 O4'-C1'-N19 111.295 3.095 . 0.209 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.693 ' C6 ' ' N7 ' ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.43 -1.894 0 C5'-C4'-C3' 110.908 -3.061 . 0.035 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.693 ' N7 ' ' C6 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.747 0 C5'-C4'-C3' 110.857 -3.096 . 0.522 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.683 " O2'" ' C8 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.22 0 C5'-C4'-C3' 110.817 -3.122 OUTLIER-EPSILON 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.683 ' C8 ' " O2'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.656 0 C5'-C4'-C3' 110.989 -3.007 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.587 " O2'" " O4'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.12 0 O4'-C1'-N19 111.274 3.074 . 0.186 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.721 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.77 0 O4'-C1'-N19 111.097 2.897 . 0.072 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.888 HO2' ' H6 ' ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.523 0 C3'-C2'-C1' 104.749 3.609 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.914 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.979 0 O4'-C1'-N19 111.317 3.117 . 0.01 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.716 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.211 0 O4'-C1'-N19 111.798 3.598 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.834 ' H6 ' " O5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 P--O5' 1.614 2.145 0 C5'-C4'-C3' 111.542 -2.639 . 0.058 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.441 2.289 0 O4'-C1'-N19 111.383 3.183 . 0.381 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.675 HO2' " C5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.449 0 O4'-C1'-N19 111.222 3.022 . 0.162 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.692 ' H6 ' " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.033 0 O4'-C1'-N19 111.166 2.966 . 0.121 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.667 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.411 0 C3'-C2'-C1' 104.435 3.261 . 0.039 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.846 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.442 2.314 0 O4'-C1'-N19 111.133 2.933 . 0.166 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 0.955 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.268 0 O4'-C1'-N19 111.49 3.29 . 0.378 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 0.955 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.665 0 O4'-C1'-N19 111.411 3.211 . 0.224 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . 0.596 " H5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.414 0 C5'-C4'-C3' 111.331 -2.779 . 0.619 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.197 0 N-CA-C 112.493 -0.243 . . . . 0.0 112.493 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . 0.588 ' HB3' ' P ' ' A' ' 15' ' ' ' A' . 23.1 t -80.69 57.33 2.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.768 0.318 . . . . 0.0 111.062 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . 0.496 ' HA ' HD12 ' B' ' 366' ' ' LEU . 2.8 tp -50.9 -19.67 1.08 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.347 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.54 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -45.67 -71.88 0.07 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.354 179.601 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.702 ' HE1' ' HB3' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -38.58 -35.48 0.19 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.14 -179.129 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . 0.702 ' HB3' ' HE1' ' B' ' 368' ' ' MET . 0.0 OUTLIER -67.71 -39.38 84.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.027 0.441 . . . . 0.0 109.904 179.779 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 0.58 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -62.27 -69.99 0.22 Allowed 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.134 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.543 ' HE3' ' N ' ' B' ' 368' ' ' MET . 0.4 OUTLIER -37.23 -44.93 0.61 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.13 179.428 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.547 ' O ' ' CB ' ' B' ' 376' ' ' SER . 1.4 tmm_? -56.27 -40.68 74.63 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.897 179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.517 ' HA ' ' HB2' ' B' ' 377' ' ' LEU . 0.0 OUTLIER -64.26 -48.51 75.47 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.076 0.465 . . . . 0.0 111.273 179.871 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 0.865 HD13 ' OH ' ' B' ' 387' ' ' TYR . 0.3 OUTLIER -59.72 -70.18 0.17 Allowed 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -178.128 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . 0.553 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 4.6 m-85 -72.51 -34.49 67.65 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 113.271 0.841 . . . . 0.0 113.271 -177.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.547 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -83.58 -54.96 4.56 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.561 -179.323 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.537 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.2 OUTLIER -72.68 -35.84 67.77 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -178.625 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.537 HD13 ' O ' ' B' ' 377' ' ' LEU . 3.9 mm -137.01 36.78 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -178.515 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.553 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -127.04 90.71 0.36 Allowed Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.212 -0.994 . . . . 0.0 112.824 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.687 ' CD2' HD12 ' B' ' 383' ' ' LEU . 52.3 p90 -99.74 -160.08 0.78 Allowed 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.397 -0.223 . . . . 0.0 110.397 179.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . 0.539 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -93.61 123.03 36.65 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.8 0.333 . . . . 0.0 111.622 -179.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 3.2 m 87.78 -3.66 0.56 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.017 179.03 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.687 HD12 ' CD2' ' B' ' 380' ' ' TYR . 6.2 tt -50.63 -43.67 57.07 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.807 0.337 . . . . 0.0 111.143 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . 0.55 ' O ' HG12 ' B' ' 406' ' ' VAL . 0.1 OUTLIER 69.84 74.09 0.23 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.674 -179.827 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.656 HD21 ' HE1' ' B' ' 387' ' ' TYR . 9.9 tt -118.68 128.95 55.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.124 179.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . . . . . . . . . 41.1 p-80 -149.51 146.99 27.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.65 0.738 . . . . 0.0 112.85 -178.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.865 ' OH ' HD13 ' B' ' 374' ' ' LEU . 2.8 m-85 -101.66 141.75 34.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.661 -1.154 . . . . 0.0 110.532 178.558 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . 0.577 HG23 ' HB3' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -124.27 119.52 56.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.204 0.526 . . . . 0.0 110.777 179.317 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.8 m -80.12 122.99 27.49 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.817 -179.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 0.657 HG23 ' CG2' ' B' ' 401' ' ' ILE . 31.5 m -131.86 161.01 42.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.76 179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.785 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.2 OUTLIER 94.65 21.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.424 -179.908 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.533 ' O ' ' O ' ' B' ' 391' ' ' LYS . 0.7 OUTLIER 4.24 118.94 0.0 OUTLIER Pre-proline 0 N--CA 1.474 0.741 0 O-C-N 124.095 0.872 . . . . 0.0 112.829 179.742 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.488 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 7.0 Cg_exo -68.58 157.03 63.52 Favored 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.615 2.21 . . . . 0.0 113.586 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . 0.432 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 0.6 OUTLIER -137.24 171.77 13.99 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.472 -1.24 . . . . 0.0 111.981 -179.624 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -93.39 18.75 9.23 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-O 121.289 0.566 . . . . 0.0 110.442 179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 34.6 m -135.67 -0.53 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.195 178.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . 0.434 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 1.6 m-20 179.25 56.24 0.06 OUTLIER Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 114.871 -1.059 . . . . 0.0 108.852 -179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.488 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 73.7 Cg_exo -38.57 -35.75 0.51 Allowed 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 123.282 2.654 . . . . 0.0 112.902 -179.251 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.623 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -30.51 134.3 0.06 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.543 0.687 . . . . 0.0 112.212 -178.208 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . 0.466 ' OG ' ' HG3' ' B' ' 393' ' ' PRO . 45.8 m -143.24 151.68 40.86 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.338 -179.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 0.785 HG22 ' HB2' ' B' ' 391' ' ' LYS . 10.2 tt -109.99 156.12 11.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.962 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.75 ' HB ' ' HB2' ' B' ' 427' ' ' ALA . 0.2 OUTLIER -121.19 152.98 24.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.641 -178.369 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 0.577 ' HB3' HG23 ' B' ' 388' ' ' VAL . 2.8 mt-10 -121.24 122.6 40.29 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.764 178.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.607 ' HB3' ' CZ ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -109.97 108.1 18.23 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 179.163 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.504 ' HA ' ' O ' ' B' ' 410' ' ' THR . 1.2 ptm180 -134.58 -170.02 2.46 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.683 0.754 . . . . 0.0 112.713 -178.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.895 HG23 ' HB ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -158.64 157.75 3.16 Favored 'Isoleucine or valine' 0 C--O 1.243 0.72 0 CA-C-N 114.492 -1.231 . . . . 0.0 112.003 -178.686 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 59.0 -95.08 0.06 OUTLIER Glycine 0 N--CA 1.448 -0.55 0 CA-C-N 114.737 -1.12 . . . . 0.0 111.957 -179.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -167.08 27.1 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.753 0.311 . . . . 0.0 110.366 179.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 177.08 26.51 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 119.997 -1.097 . . . . 0.0 113.528 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.895 ' HB ' HG23 ' B' ' 406' ' ' VAL . 87.4 m -130.53 109.09 10.42 Favored 'General case' 0 C--O 1.222 -0.387 0 CA-C-N 117.168 0.484 . . . . 0.0 110.815 178.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . 0.48 ' HA ' ' HA ' ' B' ' 405' ' ' ARG . 74.1 t -101.85 116.09 44.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.654 0.264 . . . . 0.0 110.521 179.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.763 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -71.58 -35.38 70.53 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.411 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . 0.494 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 172.38 -176.07 45.42 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.15 -1.024 . . . . 0.0 112.875 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.44 ' O ' ' CG ' ' B' ' 430' ' ' ASN . 0.5 OUTLIER -145.7 155.94 43.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.728 0.299 . . . . 0.0 111.294 -179.369 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.688 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -149.41 135.48 5.36 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.301 -0.952 . . . . 0.0 112.686 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . 0.543 ' HB ' HD12 ' B' ' 401' ' ' ILE . 8.8 p -125.87 152.51 33.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.76 0.314 . . . . 0.0 110.506 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.895 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -159.95 167.24 35.33 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.739 -0.743 . . . . 0.0 111.503 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.535 ' CG ' ' OD1' ' B' ' 419' ' ' ASN . 7.4 ptm180 -71.23 -41.92 69.53 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -179.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.697 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.3 OUTLIER -107.28 34.15 3.64 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.673 0.273 . . . . 0.0 110.802 179.575 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.724 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.7 OUTLIER 55.99 -42.57 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 179.292 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.541 ' N ' HG13 ' B' ' 420' ' ' ILE . 0.0 OUTLIER -45.0 -61.47 1.61 Allowed 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 118.954 0.797 . . . . 0.0 109.721 -179.795 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.895 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -45.31 -21.9 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 109.171 -0.677 . . . . 0.0 109.171 177.851 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.724 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -86.19 -50.53 6.91 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.595 178.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . 0.433 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -57.46 -42.52 93.9 Favored Glycine 0 C--N 1.337 0.624 0 C-N-CA 120.083 -1.056 . . . . 0.0 110.998 179.112 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.538 ' CD1' ' N ' ' B' ' 425' ' ' ILE . 0.6 OUTLIER -71.16 -63.38 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 178.237 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.594 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 12.2 tpt180 -41.37 -31.29 0.23 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.681 178.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.75 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -64.51 -60.35 3.24 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.449 178.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 0.613 ' O ' HD23 ' B' ' 432' ' ' LEU . . . -57.84 -51.9 67.68 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 178.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.552 ' O ' ' HB2' ' B' ' 433' ' ' ARG . 79.7 mm-40 -55.33 -21.59 15.61 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.079 178.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.53 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.6 OUTLIER -76.71 -38.81 53.7 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.138 178.881 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.654 ' HB3' HD22 ' B' ' 374' ' ' LEU . . . -62.42 -32.68 73.56 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.328 0.585 . . . . 0.0 109.49 179.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.775 ' HA ' HD21 ' B' ' 438' ' ' LEU . 0.2 OUTLIER -96.99 3.63 51.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.071 178.709 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . 0.552 ' HB2' ' O ' ' B' ' 429' ' ' GLU . 0.0 OUTLIER -89.89 19.72 4.65 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.795 -179.964 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.533 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 15.5 m-20 -136.19 80.67 1.84 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.384 179.457 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.576 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.3 OUTLIER -47.18 -57.25 5.34 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.211 -179.905 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.576 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 2.5 mtmt -49.3 -42.49 41.43 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.28 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.763 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.5 OUTLIER -70.49 -50.31 39.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.585 179.603 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.775 HD21 ' HA ' ' B' ' 432' ' ' LEU . 85.4 mt -50.78 -59.58 3.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.469 0.652 . . . . 0.0 110.489 179.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -59.09 -42.66 90.99 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.47 178.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.505 ' CD1' ' C ' ' B' ' 440' ' ' PHE . 0.1 OUTLIER -42.81 -48.96 5.8 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 179.368 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.518 ' OH ' HG21 ' B' ' 410' ' ' THR . 55.1 m-85 -62.57 -46.3 88.98 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.56 179.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . 0.456 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -39.12 -61.69 0.73 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 178.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 1.4 tmtt? -49.47 -49.92 43.47 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 178.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.528 ' O ' ' N ' ' B' ' 447' ' ' ALA . 0.0 OUTLIER -51.04 -59.01 4.62 Favored 'General case' 0 C--N 1.334 -0.085 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 178.878 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.495 ' HA ' HG12 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -38.1 -41.67 0.6 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.495 178.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -69.46 -38.16 77.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.896 179.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . 0.528 ' N ' ' O ' ' B' ' 444' ' ' GLN . . . -72.64 -71.46 0.29 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.696 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.511 ' C ' ' O ' ' B' ' 447' ' ' ALA . 1.2 pt -15.14 116.02 0.05 OUTLIER Pre-proline 0 N--CA 1.464 0.266 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.397 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -77.7 93.95 1.08 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.907 2.405 . . . . 0.0 112.334 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -51.4 148.56 4.86 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.969 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -48.37 158.39 0.27 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.014 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -148.15 32.35 0.83 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.732 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.213 -0.898 . . . . 0.0 110.911 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.807 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 C2'--O2' 1.433 1.526 0 C5'-C4'-C3' 110.889 -3.074 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.807 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.279 0 O4'-C1'-N19 111.512 3.312 . 0.027 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.597 " O2'" " O5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.673 0 C3'-C2'-C1' 104.933 3.815 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.597 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.321 0 C5'-C4'-C3' 111.131 -2.913 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.56 " O2'" ' HB2' ' B' ' 393' ' ' PRO . . . . . . . . 0 O4'--C1' 1.441 2.282 0 O4'-C1'-N19 111.221 3.021 . 0.109 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.485 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.576 0 O4'-C1'-N19 110.985 2.785 . 0.06 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.485 ' C6 ' " H2'" ' A' ' 6' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.051 0 O4'-C1'-N19 111.451 3.251 . 0.153 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.639 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.442 2.368 0 O4'-C1'-N19 110.97 2.77 . 0.183 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.639 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.4 0 O4'-C1'-N19 111.083 2.883 . 0.293 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.636 " O2'" " C5'" ' A' ' 11' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.438 2.006 0 O4'-C1'-N19 111.076 2.876 . 0.101 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.636 " C5'" " O2'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.272 0 O4'-C1'-N19 111.077 2.877 . 0.034 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.879 " O5'" ' H6 ' ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.436 1.831 0 O4'-C1'-N19 111.23 3.03 . 0.055 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.772 " O2'" " H5'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.878 0 O4'-C1'-N19 111.161 2.961 . 0.066 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.772 " H5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.636 0 C3'-C2'-C1' 104.083 2.87 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.929 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.311 0 C5'-C4'-C3' 110.966 -3.023 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.929 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -1.981 0 O4'-C1'-N19 111.483 3.283 OUTLIER-DELTA 0.028 1b . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.591 " O2'" " C1'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -2.035 0 C5'-C4'-C3' 110.886 -3.076 . 0.0 OUTLIER alpha 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.652 ' N6 ' ' N3 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.435 1.741 0 O4'-C1'-N19 111.025 2.825 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.875 " O2'" " H5'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.039 0 O4'-C1'-N19 111.238 3.038 . 0.269 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.875 " H5'" " O2'" ' A' ' 19' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.441 0 C3'-C2'-C1' 104.494 3.326 . 0.126 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.55 " O2'" " C5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.43 -1.906 0 C5'-C4'-C3' 110.997 -3.002 . 0.021 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.868 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.436 1.856 0 O4'-C1'-N19 111.144 2.944 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.672 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.261 0 O4'-C1'-N19 111.877 3.677 . 0.065 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.781 ' H6 ' " O5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.236 0 C5'-C4'-C3' 111.448 -2.701 . 0.066 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . 0.512 ' O6 ' ' O4 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.237 0 O4'-C1'-N19 111.316 3.116 . 0.426 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.502 " H2'" ' C6 ' ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.494 0 C5'-C4'-C3' 111.183 -2.878 . 0.087 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.869 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 P--O5' 1.613 2.023 0 C5'-C4'-C3' 111.273 -2.818 . 0.153 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.869 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.472 0 C3'-C2'-C1' 104.903 3.781 . 0.013 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.898 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.24 0 O4'-C1'-N19 111.319 3.119 . 0.08 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 0.898 " H5'" " O2'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.342 0 O4'-C1'-N19 111.39 3.19 . 0.437 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 0.849 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.592 0 O4'-C1'-N19 111.476 3.276 . 0.05 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . 0.424 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.765 0 C3'-C2'-C1' 104.342 3.158 . 0.271 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.215 0 N-CA-C 112.494 -0.243 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 54.3 54.23 9.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.917 0.389 . . . . 0.0 110.948 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . 0.451 ' HB3' ' HB2' ' B' ' 369' ' ' ASN . 0.1 OUTLIER -119.43 118.02 30.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.906 179.918 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.646 ' HA ' HG23 ' B' ' 425' ' ' ILE . 33.9 t0 -61.04 -61.28 2.69 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.256 179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.476 ' HA ' ' CE ' ' B' ' 371' ' ' LYS . 2.1 tmm? -35.51 -53.61 0.67 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.496 179.586 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . 0.451 ' HB2' ' HB3' ' B' ' 366' ' ' LEU . 1.1 m-80 -60.19 -45.49 92.94 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.28 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 1.027 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -61.36 -71.7 0.14 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.244 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.476 ' CE ' ' HA ' ' B' ' 368' ' ' MET . 0.1 OUTLIER -34.94 -50.75 0.49 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.901 0.381 . . . . 0.0 110.473 -179.836 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.575 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.3 OUTLIER -55.56 -41.59 73.5 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.881 179.669 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.666 ' OE1' HD23 ' B' ' 377' ' ' LEU . 0.3 OUTLIER -66.1 -61.06 2.24 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.141 0.496 . . . . 0.0 110.798 179.601 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 1.072 HD11 ' CB ' ' B' ' 428' ' ' ALA . 0.4 OUTLIER -46.79 -73.24 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.577 0.955 . . . . 0.0 113.577 -178.571 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . 0.47 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.5 m-85 -92.3 -4.93 53.24 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 114.402 1.26 . . . . 0.0 114.402 -176.496 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.575 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -113.72 5.28 16.35 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.078 -0.649 . . . . 0.0 110.66 179.122 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.666 HD23 ' OE1' ' B' ' 373' ' ' GLN . 3.7 tp -144.51 -35.85 0.34 Allowed 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.281 179.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.672 HG23 ' CB ' ' B' ' 441' ' ' TYR . 5.5 mm -135.36 38.21 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -179.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.569 ' HA2' HD21 ' B' ' 383' ' ' LEU . . . -149.81 68.18 0.34 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.591 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.712 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 15.1 p90 -74.97 -50.9 15.09 Favored 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 121.071 -0.251 . . . . 0.0 110.696 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . 0.712 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 158.04 -14.75 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 178.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . 0.438 ' HG ' ' HE2' ' B' ' 380' ' ' TYR . 0.5 OUTLIER -124.0 31.69 5.76 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -178.456 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.569 HD21 ' HA2' ' B' ' 379' ' ' GLY . 0.1 OUTLIER -101.0 -8.92 21.93 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.855 0.359 . . . . 0.0 110.537 178.703 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 57.4 44.05 22.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.145 -0.479 . . . . 0.0 109.95 -179.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.833 ' HA ' HG12 ' B' ' 406' ' ' VAL . 9.8 tt -90.96 125.84 35.9 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . 0.514 ' O ' ' O ' ' B' ' 405' ' ' ARG . 2.3 p-80 -144.96 148.89 34.31 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 113.388 0.885 . . . . 0.0 113.388 -178.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.436 ' CE1' HD21 ' B' ' 385' ' ' LEU . 18.2 m-85 -109.63 148.91 30.49 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.738 -1.119 . . . . 0.0 109.549 177.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . 0.826 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -125.18 125.44 69.28 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.149 0.5 . . . . 0.0 110.699 179.44 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . 0.522 ' O ' ' CG2' ' B' ' 389' ' ' THR . 0.5 OUTLIER -83.84 117.0 23.01 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.453 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 0.921 HG23 HG23 ' B' ' 401' ' ' ILE . 33.9 m -130.52 146.74 33.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.156 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.561 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.3 OUTLIER 94.0 19.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.452 -0.795 . . . . 0.0 111.092 -179.812 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.516 ' C ' ' O ' ' B' ' 391' ' ' LYS . 6.4 mttt -6.27 108.32 0.03 OUTLIER Pre-proline 0 N--CA 1.469 0.479 0 O-C-N 123.952 0.782 . . . . 0.0 112.579 179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.56 ' HB2' " O2'" ' A' ' 5' ' ' ' U' . 5.5 Cg_exo -47.51 157.14 0.9 Allowed 'Trans proline' 0 N--CA 1.458 -0.575 0 C-N-CA 122.661 2.241 . . . . 0.0 113.195 -179.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . 0.486 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 1.3 p -150.35 164.95 34.51 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.934 -1.03 . . . . 0.0 111.429 179.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -78.18 5.93 9.18 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-O 120.842 0.353 . . . . 0.0 111.297 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . 0.492 ' O ' ' HB2' ' B' ' 397' ' ' ASP . 4.3 m -132.1 12.84 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.454 0.645 . . . . 0.0 109.352 178.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . 0.492 ' HB2' ' O ' ' B' ' 396' ' ' VAL . 32.1 t70 172.56 56.82 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.153 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.494 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 1.5 Cg_endo -44.41 -61.09 0.63 Allowed 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 123.253 2.635 . . . . 0.0 111.856 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.565 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 1.1 p-10 -22.72 137.04 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.899 -1.046 . . . . 0.0 112.221 -179.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 45.9 t -140.57 154.78 46.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.945 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 0.921 HG23 HG23 ' B' ' 390' ' ' VAL . 0.4 OUTLIER -116.72 142.88 28.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.837 -0.619 . . . . 0.0 111.317 -179.742 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.716 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -107.4 156.35 7.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.666 -179.764 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 0.826 ' CB ' HG23 ' B' ' 388' ' ' VAL . 0.0 OUTLIER -121.6 110.48 16.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.258 179.114 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.802 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 5.7 t -90.5 100.09 12.99 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.855 179.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.514 ' O ' ' O ' ' B' ' 386' ' ' HIS . 6.3 ptm180 -143.25 161.99 36.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.392 0.615 . . . . 0.0 111.889 -178.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.833 HG12 ' HA ' ' B' ' 385' ' ' LEU . 5.3 m -142.13 151.01 18.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.289 179.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 71.32 3.58 53.67 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.02 -1.086 . . . . 0.0 112.081 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 69.28 21.96 6.85 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.737 0.304 . . . . 0.0 110.78 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -146.25 -46.66 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.424 -0.893 . . . . 0.0 113.182 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.49 ' O ' ' HB2' ' B' ' 405' ' ' ARG . 69.0 m -80.41 125.77 30.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.863 0.364 . . . . 0.0 111.669 -179.365 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 52.9 t -107.88 104.15 16.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.908 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.663 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.1 OUTLIER -61.47 -26.07 67.65 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.586 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 160.02 -154.14 25.16 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.466 -0.788 . . . . 0.0 112.3 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.598 ' OG1' HD11 ' B' ' 401' ' ' ILE . 4.6 t -163.25 162.8 25.47 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.108 0.48 . . . . 0.0 111.797 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.55 ' CA ' ' HG2' ' B' ' 426' ' ' ARG . . . -148.04 151.06 23.34 Favored Glycine 0 C--O 1.224 -0.509 0 C-N-CA 120.343 -0.932 . . . . 0.0 113.148 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . 0.674 ' HB ' HD12 ' B' ' 401' ' ' ILE . 5.5 p -142.8 149.6 18.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.728 0.299 . . . . 0.0 110.992 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.94 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -161.3 170.49 37.09 Favored Glycine 0 C--O 1.227 -0.334 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.345 179.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.519 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 0.0 OUTLIER -81.95 -44.0 17.33 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-N 116.903 0.351 . . . . 0.0 111.411 179.951 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.743 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.2 OUTLIER -99.99 37.08 1.7 Allowed 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 179.52 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.718 ' C ' HD12 ' B' ' 420' ' ' ILE . 0.6 OUTLIER 48.27 -46.47 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 N-CA-C 115.2 1.556 . . . . 0.0 115.2 178.468 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.706 ' N ' HD12 ' B' ' 420' ' ' ILE . 0.0 OUTLIER -43.3 -56.5 3.48 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -179.51 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.94 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -47.37 -22.26 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.887 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.716 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -83.17 -46.65 12.48 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 177.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . 0.523 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -58.94 -51.5 58.82 Favored Glycine 0 C--N 1.334 0.431 0 N-CA-C 110.271 -1.131 . . . . 0.0 110.271 177.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.826 HD13 ' N ' ' B' ' 425' ' ' ILE . 0.9 OUTLIER -61.5 -66.33 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 177.893 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.595 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 7.0 tpt180 -39.02 -32.93 0.1 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.355 -0.839 . . . . 0.0 110.551 179.167 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.498 ' HB3' ' O ' ' B' ' 424' ' ' GLY . . . -62.88 -57.67 10.03 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 178.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 1.072 ' CB ' HD11 ' B' ' 374' ' ' LEU . . . -58.24 -53.78 54.44 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.235 178.317 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.676 ' HA ' HD21 ' B' ' 432' ' ' LEU . 0.5 OUTLIER -54.47 -17.33 3.03 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.936 179.229 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.501 ' OD1' ' N ' ' B' ' 414' ' ' THR . 1.1 m-80 -81.77 -36.75 28.14 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 178.436 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.802 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -68.4 -39.43 81.68 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.349 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.752 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.8 OUTLIER -83.24 10.27 8.81 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.85 0.357 . . . . 0.0 111.013 179.954 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -86.95 -8.11 57.53 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.455 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.439 ' O ' ' HG ' ' B' ' 438' ' ' LEU . 1.1 m-20 -117.8 80.52 1.52 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.655 -179.381 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.569 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 1.9 ptpp? -49.68 -54.32 19.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.242 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.569 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -50.35 -39.01 45.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.098 0.475 . . . . 0.0 110.203 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.663 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.8 OUTLIER -76.52 -40.96 48.5 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.811 178.927 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.752 HD11 ' HA ' ' B' ' 432' ' ' LEU . 83.4 mt -58.36 -64.54 0.89 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.985 179.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -49.88 -43.35 49.29 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 178.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.486 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -45.32 -42.49 9.91 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 179.382 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.672 ' CB ' HG23 ' B' ' 378' ' ' ILE . 41.8 m-85 -66.62 -45.78 77.96 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.858 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . 0.435 ' O ' ' HB2' ' B' ' 445' ' ' ARG . . . -41.99 -59.74 1.64 Allowed 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 3.6 tttp -49.92 -44.59 50.43 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 178.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.518 ' HG2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -63.12 -12.09 24.86 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.65 179.318 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.728 ' O ' HD11 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -90.41 -36.85 14.35 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.821 -179.746 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -85.74 -37.4 19.39 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.939 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . 0.446 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -59.23 -53.38 58.98 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.801 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.728 HD11 ' O ' ' B' ' 445' ' ' ARG . 1.1 pt -29.77 105.51 0.22 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.814 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_exo -51.62 -167.39 0.0 OUTLIER 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.922 2.414 . . . . 0.0 112.36 179.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . 0.429 ' C ' ' OG ' ' B' ' 451' ' ' SER . 0.6 OUTLIER -177.37 -50.53 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.139 179.86 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . 0.429 ' OG ' ' C ' ' B' ' 450' ' ' ARG . 0.0 OUTLIER 179.86 -175.78 0.3 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.914 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . 0.418 ' O ' ' C ' ' B' ' 453' ' ' SER . 6.0 mt-10 65.26 76.4 0.33 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.888 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . 0.418 ' C ' ' O ' ' B' ' 452' ' ' GLU . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.337 -0.84 . . . . 0.0 111.014 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.587 " O2'" " O5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.785 0 C3'-C2'-C1' 104.377 3.197 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.943 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.163 0 O4'-C1'-N19 111.484 3.284 . 0.061 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.943 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.176 0 O4'-C1'-N19 111.315 3.115 . 0.088 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.523 " H2'" ' C6 ' ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.197 0 O4'-C1'-N19 111.473 3.273 . 0.239 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.778 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.022 0 O4'-C1'-N19 111.165 2.965 . 0.023 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.518 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.255 0 O4'-C1'-N19 111.161 2.961 . 0.144 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.762 ' H6 ' " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.952 0 O4'-C1'-N19 111.615 3.415 . 0.292 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.676 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.153 0 O4'-C1'-N19 110.952 2.752 . 0.148 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.676 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.231 0 O4'-C1'-N19 111.239 3.039 . 0.068 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.9 ' H6 ' " O5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 P--O5' 1.611 1.837 0 O4'-C1'-N19 111.247 3.047 . 0.064 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.582 " O2'" " O5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.35 0 O4'-C1'-N19 111.165 2.965 . 0.028 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.803 " O5'" ' H6 ' ' A' ' 12' ' ' ' U' . . . . . . . . 0 P--O5' 1.611 1.823 0 O4'-C1'-N19 111.14 2.94 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.792 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.641 0 C3'-C2'-C1' 104.692 3.547 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.651 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.454 0 O4'-C1'-N19 111.35 3.15 . 0.037 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.859 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.428 -2.045 0 C5'-C4'-C3' 110.849 -3.101 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.859 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.432 -1.745 0 O4'-C1'-N19 111.775 3.575 . 0.0 OUTLIER alpha 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.71 ' N7 ' H5'' ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.429 -1.986 0 C5'-C4'-C3' 110.776 -3.149 OUTLIER-EPSILON 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.709 ' P ' " O2'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.716 0 C5'-C4'-C3' 110.967 -3.022 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.704 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.269 0 O4'-C1'-N19 111.298 3.098 . 0.012 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.741 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.436 1.836 0 C5'-C4'-C3' 111.217 -2.855 . 0.149 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.741 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.389 0 C5'-C4'-C3' 110.851 -3.099 . 0.31 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.854 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.003 0 O4'-C1'-N19 111.098 2.898 . 0.09 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.817 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.228 0 O4'-C1'-N19 111.812 3.612 . 0.034 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.779 ' H6 ' " O5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.042 0 O4'-C1'-N19 110.88 2.68 . 0.082 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.441 2.242 0 O4'-C1'-N19 111.238 3.038 . 0.444 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.49 " H2'" ' C6 ' ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.44 0 O4'-C1'-N19 111.129 2.929 . 0.166 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.91 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.179 0 O4'-C1'-N19 111.169 2.969 . 0.302 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.91 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.414 0 C3'-C2'-C1' 104.333 3.148 . 0.121 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.719 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.125 0 C5'-C4'-C3' 111.258 -2.828 . 0.171 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 1.048 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.159 0 O4'-C1'-N19 111.572 3.372 . 0.378 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 1.048 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.527 0 O4'-C1'-N19 111.232 3.032 . 0.245 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.39 0 O4'-C1'-N19 111.139 2.939 . 0.43 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.139 0 N-CA-C 112.55 -0.22 . . . . 0.0 112.55 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 14.8 m 59.97 59.68 2.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.903 0.382 . . . . 0.0 110.746 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -138.32 132.93 32.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.017 -179.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.544 ' HB3' ' CG1' ' B' ' 425' ' ' ILE . 0.3 OUTLIER -54.67 -68.48 0.18 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 179.44 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.544 ' N ' ' HE2' ' B' ' 371' ' ' LYS . 12.5 tmm? -34.84 -45.59 0.26 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.491 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -62.57 -44.41 96.39 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.872 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 0.755 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -60.36 -69.68 0.21 Allowed 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 179.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.544 ' HE2' ' N ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -34.13 -51.02 0.42 Allowed 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.509 179.894 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.559 ' O ' ' CB ' ' B' ' 376' ' ' SER . 2.3 tmm_? -56.96 -40.05 75.76 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.783 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.556 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -62.28 -59.03 5.61 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.121 0.486 . . . . 0.0 110.322 178.846 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 0.759 HD21 HD23 ' B' ' 432' ' ' LEU . 1.7 mt -47.56 -72.65 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.3 -0.864 . . . . 0.0 113.162 -178.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . 0.456 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 24.9 m-85 -74.18 -48.45 29.04 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 -176.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.559 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -63.25 -54.6 34.7 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.652 -178.576 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.563 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.2 OUTLIER -71.78 -43.85 65.0 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -178.331 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.595 HG22 HD13 ' B' ' 383' ' ' LEU . 8.7 mm -114.59 -58.98 3.34 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 N-CA-C 113.416 0.895 . . . . 0.0 113.416 -177.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.456 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -63.56 66.44 0.04 OUTLIER Glycine 0 CA--C 1.516 0.131 0 C-N-CA 121.14 -0.553 . . . . 0.0 113.117 -179.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.683 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 10.4 p90 -49.01 -35.45 15.43 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 111.567 0.21 . . . . 0.0 111.567 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . 0.683 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 151.48 -10.31 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.586 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . 0.43 ' O ' ' OH ' ' B' ' 380' ' ' TYR . 0.3 OUTLIER -147.43 50.85 1.07 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.916 0.389 . . . . 0.0 110.426 179.715 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.612 HD12 ' HE1' ' B' ' 380' ' ' TYR . 0.8 OUTLIER -106.13 -15.67 14.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.793 -179.961 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . 0.513 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 0.2 OUTLIER 65.89 60.6 0.67 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.111 179.808 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.89 ' HG ' HG12 ' B' ' 406' ' ' VAL . 2.6 tt -105.67 124.62 49.85 Favored 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 110.352 -0.24 . . . . 0.0 110.352 179.559 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . 0.544 ' O ' ' O ' ' B' ' 405' ' ' ARG . 15.2 p-80 -144.0 148.27 35.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.612 0.72 . . . . 0.0 112.746 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.621 ' OH ' HD13 ' B' ' 374' ' ' LEU . 35.3 m-85 -107.23 144.69 33.65 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.388 -0.823 . . . . 0.0 111.266 179.077 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . 0.685 HG23 ' HB3' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -125.83 125.92 69.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.762 179.332 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.1 m -88.01 122.43 31.6 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.209 -179.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 0.912 HG23 HG23 ' B' ' 401' ' ' ILE . 18.2 m -125.1 157.64 33.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.192 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.618 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.2 OUTLIER 89.56 24.07 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.197 179.954 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.52 ' C ' ' O ' ' B' ' 391' ' ' LYS . 8.2 mmpt? 5.44 108.51 0.01 OUTLIER Pre-proline 0 N--CA 1.471 0.605 0 O-C-N 123.938 0.774 . . . . 0.0 112.317 179.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.486 ' HD2' ' HA ' ' B' ' 392' ' ' LYS . 3.3 Cg_endo -51.31 162.57 1.29 Allowed 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.709 2.273 . . . . 0.0 113.891 -179.119 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 2.5 p -126.58 160.2 31.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 114.512 -1.222 . . . . 0.0 111.573 -179.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -91.78 20.35 5.68 Favored 'General case' 0 C--O 1.231 0.111 0 CA-C-O 121.316 0.579 . . . . 0.0 110.573 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . 0.937 HG12 " O2'" ' A' ' 30' ' ' ' C' . 23.1 m -138.32 13.52 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.323 177.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . 0.47 ' O ' ' N ' ' B' ' 399' ' ' ASN . 0.7 OUTLIER 159.23 64.28 0.0 OUTLIER Pre-proline 0 N--CA 1.451 -0.392 0 CA-C-N 114.659 -1.155 . . . . 0.0 108.79 -179.238 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.518 ' O ' ' C ' ' B' ' 399' ' ' ASN . 83.4 Cg_exo -37.34 -23.2 0.05 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.322 0 C-N-CA 123.63 2.886 . . . . 0.0 113.676 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.518 ' C ' ' O ' ' B' ' 398' ' ' PRO . 21.1 m120 -20.57 109.4 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.271 0 O-C-N 123.537 0.523 . . . . 0.0 111.537 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 38.1 t -131.78 146.3 52.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.256 -179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 0.912 HG23 HG23 ' B' ' 390' ' ' VAL . 0.0 OUTLIER -108.29 151.76 10.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.37 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.696 ' HB ' ' HB2' ' B' ' 427' ' ' ALA . 0.2 OUTLIER -119.45 157.93 21.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.781 -178.692 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 0.685 ' HB3' HG23 ' B' ' 388' ' ' VAL . 0.7 OUTLIER -121.34 118.31 29.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.741 178.895 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.546 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -93.09 98.53 11.38 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.222 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.549 ' HA ' ' O ' ' B' ' 410' ' ' THR . 1.0 OUTLIER -133.69 158.2 43.86 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.348 0.594 . . . . 0.0 112.033 -178.291 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.994 HG13 HD21 ' B' ' 412' ' ' LEU . 2.6 m -138.88 178.65 3.77 Favored 'Isoleucine or valine' 0 C--O 1.238 0.463 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.234 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . 0.457 ' O ' ' HG2' ' B' ' 384' ' ' ARG . . . 64.77 -92.55 0.13 Allowed Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.898 -0.667 . . . . 0.0 112.375 179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -163.64 25.94 0.08 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.902 0.382 . . . . 0.0 110.588 179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . 0.474 ' HA2' ' NE ' ' B' ' 405' ' ' ARG . . . 163.66 -12.56 0.09 OUTLIER Glycine 0 CA--C 1.522 0.477 0 C-N-CA 120.445 -0.883 . . . . 0.0 113.643 -179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.549 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 42.4 m -71.8 134.24 46.03 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 117.531 0.665 . . . . 0.0 110.646 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . 0.566 HG13 ' OE1' ' B' ' 403' ' ' GLU . 80.3 t -119.18 114.11 43.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.742 0.306 . . . . 0.0 111.733 -179.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.994 HD21 HG13 ' B' ' 406' ' ' VAL . 0.2 OUTLIER -75.29 -32.45 61.0 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.145 179.024 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . 0.457 ' O ' ' SG ' ' B' ' 404' ' ' CYS . . . 174.4 -168.74 41.58 Favored Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.003 -1.094 . . . . 0.0 113.319 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.504 ' OG1' HD11 ' B' ' 401' ' ' ILE . 0.1 OUTLIER -146.42 158.46 43.89 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.572 -0.314 . . . . 0.0 111.612 -179.161 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.586 ' CA ' ' CG ' ' B' ' 426' ' ' ARG . . . -152.06 138.11 6.3 Favored Glycine 0 C--O 1.225 -0.418 0 C-N-CA 120.451 -0.881 . . . . 0.0 112.833 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . 0.431 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 12.9 p -119.63 150.3 22.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 179.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.797 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -159.73 148.6 17.42 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.267 -0.968 . . . . 0.0 112.262 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.487 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 4.3 ptt85 -67.51 -42.47 82.78 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.788 0.327 . . . . 0.0 111.434 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.806 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.1 OUTLIER -100.3 26.74 6.26 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.959 179.358 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.795 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 55.14 -46.21 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 179.597 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.516 ' O ' ' N ' ' B' ' 424' ' ' GLY . 0.0 OUTLIER -44.53 -58.51 2.95 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 119.913 -0.715 . . . . 0.0 109.239 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.806 HD11 ' H ' ' B' ' 419' ' ' ASN . 0.1 OUTLIER -46.0 -27.92 0.75 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.426 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 177.563 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.795 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -70.97 -51.09 27.71 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 176.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . 0.516 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -61.11 -44.2 98.46 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.23 -0.986 . . . . 0.0 111.474 178.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.681 ' N ' HD12 ' B' ' 425' ' ' ILE . 1.4 mp -81.63 -3.45 6.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 120.715 0.293 . . . . 0.0 111.391 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.612 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -96.71 -29.67 13.66 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 176.839 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.696 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -69.95 -42.58 73.04 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 107.531 -1.285 . . . . 0.0 107.531 176.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 0.755 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -63.13 -56.93 12.6 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' B' ' 425' ' ' ILE . 0.0 OUTLIER -51.41 -22.06 2.73 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.574 178.231 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.47 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.9 OUTLIER -79.47 -39.25 32.65 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.955 179.166 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.766 ' O ' HD21 ' B' ' 438' ' ' LEU . . . -67.25 -30.42 70.32 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.146 -179.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.969 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.2 OUTLIER -95.47 8.24 43.85 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.877 179.772 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.73 -17.23 36.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.077 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.558 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 0.7 OUTLIER -102.85 82.94 2.17 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.163 -179.12 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.569 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 12.0 ptmt -52.15 -54.69 27.55 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.924 0.392 . . . . 0.0 110.053 179.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.569 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 1.5 mmpt? -51.73 -42.67 62.48 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.59 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.974 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.2 OUTLIER -71.78 -48.99 42.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.004 0.43 . . . . 0.0 110.145 179.188 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.969 HD11 ' HA ' ' B' ' 432' ' ' LEU . 83.1 mt -52.97 -60.9 2.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.433 0.635 . . . . 0.0 110.019 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . 0.519 ' O ' ' N ' ' B' ' 442' ' ' ALA . 29.1 t70 -56.01 -44.35 78.59 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.264 -0.88 . . . . 0.0 108.897 178.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.482 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.6 OUTLIER -43.38 -45.01 5.96 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 179.343 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.54 ' HB3' HG23 ' B' ' 378' ' ' ILE . 45.5 m-85 -64.85 -39.42 93.53 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.044 -0.98 . . . . 0.0 109.936 178.368 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . 0.519 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -45.34 -62.54 1.22 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.069 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -45.87 -48.92 15.89 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 108.779 -0.822 . . . . 0.0 108.779 178.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.499 ' HB2' ' O ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -50.2 -54.58 19.94 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.037 178.148 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.604 ' HG2' ' CD1' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -41.71 -42.77 2.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.13 179.048 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -72.42 -38.0 68.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.286 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . 0.491 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -66.85 -64.05 0.93 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.022 -179.205 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.555 ' CG1' ' O ' ' B' ' 445' ' ' ARG . 0.9 OUTLIER -20.87 95.92 0.05 OUTLIER Pre-proline 0 C--N 1.333 -0.149 0 O-C-N 123.766 0.667 . . . . 0.0 112.115 -179.936 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_exo -40.68 -56.74 1.5 Allowed 'Trans proline' 0 N--CA 1.462 -0.337 0 C-N-CA 122.888 2.392 . . . . 0.0 112.593 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.77 141.19 20.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.85 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 12.9 p -69.77 106.11 3.0 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.772 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -57.28 -29.38 63.81 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.802 -179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 4.3 t . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.213 -0.899 . . . . 0.0 110.932 179.903 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.814 ' H8 ' " O5'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.433 1.558 0 O4'-C1'-N19 111.185 2.985 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.599 ' C6 ' ' C5 ' ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.246 0 O4'-C1'-N19 111.361 3.161 . 0.215 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.629 " O2'" " C5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.569 0 C5'-C4'-C3' 111.377 -2.749 . 0.13 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.629 " C5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.238 0 C5'-C4'-C3' 111.223 -2.851 . 0.122 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.546 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.114 0 O4'-C1'-N19 111.238 3.038 . 0.13 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.519 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.401 0 O4'-C1'-N19 111.203 3.003 . 0.058 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.679 ' H6 ' " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.054 0 O4'-C1'-N19 111.482 3.282 . 0.131 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.504 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.442 2.327 0 O4'-C1'-N19 111.055 2.855 . 0.262 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.504 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.322 0 O4'-C1'-N19 111.091 2.891 . 0.094 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.776 ' H6 ' " O5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 1.959 0 C5'-C4'-C3' 110.935 -3.043 . 0.3 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.651 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.195 0 O4'-C1'-N19 111.127 2.927 . 0.053 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.746 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.437 1.917 0 O4'-C1'-N19 111.311 3.111 . 0.025 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.746 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.428 -2.049 0 O4'-C1'-N19 111.335 3.135 . 0.027 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.654 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.139 0 C5'-C4'-C3' 111.163 -2.891 . 0.057 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.631 " O2'" ' N1 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.431 -1.797 0 C5'-C4'-C3' 110.882 -3.079 . 0.225 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.611 " H4'" ' OP2' ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.431 -1.863 0 C5'-C4'-C3' 110.743 -3.171 OUTLIER-EPSILON 0.051 1b . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.766 " H1'" ' OP1' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.363 0 C5'-C4'-C3' 110.686 -3.209 OUTLIER-EPSILON 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.766 ' OP1' " H1'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 P--O5' 1.612 1.865 0 O4'-C1'-N19 111.336 3.136 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.654 ' C4 ' ' NH2' ' B' ' 372' ' ' ARG . . . . . . . . 0 O4'--C1' 1.439 2.119 0 O4'-C1'-N19 111.26 3.06 . 0.077 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.864 " H2'" " O4'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.434 1.672 0 C5'-C4'-C3' 110.979 -3.014 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.864 " O4'" " H2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.441 0 C5'-C4'-C3' 110.796 -3.136 . 0.033 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.858 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.921 0 C5'-C4'-C3' 111.142 -2.905 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.815 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.309 0 O4'-C1'-N19 111.564 3.364 . 0.043 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.775 ' H6 ' " O5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 P--O5' 1.615 2.163 0 C5'-C4'-C3' 111.332 -2.779 . 0.074 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.443 2.408 0 O4'-C1'-N19 111.372 3.172 . 0.356 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.418 " H2'" ' C6 ' ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.326 0 O4'-C1'-N19 111.351 3.151 . 0.111 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.708 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.101 0 O4'-C1'-N19 111.149 2.949 . 0.175 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.708 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.283 0 C5'-C4'-C3' 111.002 -2.999 . 0.078 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.745 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.243 0 O4'-C1'-N19 111.179 2.979 . 0.136 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 0.955 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.356 0 O4'-C1'-N19 111.453 3.253 . 0.077 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 0.955 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.661 0 C3'-C2'-C1' 104.243 3.047 . 0.149 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . 0.566 " H5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.528 0 O4'-C1'-N19 111.225 3.025 . 0.448 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.24 0 N-CA-C 112.363 -0.295 . . . . 0.0 112.363 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . 0.467 ' O ' ' SD ' ' B' ' 368' ' ' MET . 0.8 OUTLIER -136.9 57.57 1.76 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.805 0.336 . . . . 0.0 110.826 -179.913 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . 0.501 ' O ' ' HB2' ' B' ' 369' ' ' ASN . 7.5 mt -45.0 -24.24 0.21 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.352 -179.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.8 ' HA ' HG23 ' B' ' 425' ' ' ILE . 0.0 OUTLIER -45.75 -71.92 0.07 Allowed 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 178.844 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.603 ' CE ' ' ND2' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -34.37 -44.61 0.2 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.558 179.311 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . 0.603 ' ND2' ' CE ' ' B' ' 368' ' ' MET . 4.5 m-20 -56.33 -52.18 65.51 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.916 0.388 . . . . 0.0 110.529 179.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 0.802 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -61.22 -70.7 0.17 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.67 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.453 ' HG2' " O2'" ' A' ' 20' ' ' ' A' . 0.3 OUTLIER -36.6 -38.82 0.18 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.134 0.493 . . . . 0.0 110.428 179.924 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.655 ' CZ ' ' C2 ' ' A' ' 18' ' ' ' A' . 0.0 OUTLIER -65.34 -42.32 92.98 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.883 179.799 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.646 ' HG2' HD22 ' B' ' 377' ' ' LEU . 0.1 OUTLIER -59.14 -44.75 92.07 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.583 0.706 . . . . 0.0 110.264 179.136 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -58.68 -69.77 0.18 Allowed 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 -178.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . 0.485 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 5.2 m-30 -96.67 12.03 33.28 Favored 'General case' 0 CA--C 1.518 -0.27 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -176.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.759 ' O ' HD12 ' B' ' 377' ' ' LEU . 0.7 OUTLIER -129.81 -1.3 4.78 Favored 'General case' 0 C--N 1.316 -0.849 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.571 179.268 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.759 HD12 ' O ' ' B' ' 376' ' ' SER . 8.8 mp -140.25 -27.52 0.75 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.279 178.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.753 HD13 ' O ' ' B' ' 377' ' ' LEU . 4.5 mm -144.38 39.25 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.169 0 CA-C-O 120.644 0.259 . . . . 0.0 111.536 -179.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.485 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -121.72 97.41 0.61 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.447 -0.882 . . . . 0.0 112.895 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.575 ' CE1' ' HB2' ' B' ' 383' ' ' LEU . 46.4 p90 -124.11 -172.98 2.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.639 0.257 . . . . 0.0 110.634 179.429 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . 0.505 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -96.36 83.17 3.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.42 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . 0.505 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 3.2 t 157.7 -34.8 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.103 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.701 ' O ' HD23 ' B' ' 383' ' ' LEU . 1.2 tt -45.84 -42.18 12.07 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.744 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . 0.497 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 0.9 OUTLIER 62.55 59.58 1.47 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.015 -0.538 . . . . 0.0 109.761 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.778 ' HG ' HG12 ' B' ' 406' ' ' VAL . 7.0 tt -101.32 132.64 46.76 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.869 -179.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . 0.459 ' O ' ' O ' ' B' ' 405' ' ' ARG . 24.9 p-80 -149.78 151.9 34.32 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.3 0.572 . . . . 0.0 112.419 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.661 ' HE1' HD21 ' B' ' 385' ' ' LEU . 7.1 m-85 -107.26 150.01 27.14 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.009 178.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . 0.791 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -132.42 129.88 59.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.0 179.463 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.3 m -92.31 124.29 36.26 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.661 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 1.097 HG23 HG23 ' B' ' 401' ' ' ILE . 24.2 m -128.3 158.01 40.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.161 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.544 ' HB2' HG22 ' B' ' 401' ' ' ILE . 4.0 tptp 85.82 23.34 0.08 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.67 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.523 ' C ' ' O ' ' B' ' 391' ' ' LYS . 64.2 mmtt -1.29 119.63 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.693 0 O-C-N 124.104 0.877 . . . . 0.0 112.475 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.492 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 17.8 Cg_exo -63.1 159.9 36.72 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.565 2.177 . . . . 0.0 113.077 -179.482 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . 0.487 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 3.1 p -151.79 167.84 26.96 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.621 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -84.67 10.83 10.2 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.161 0.505 . . . . 0.0 110.73 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . 0.449 ' O ' ' CB ' ' B' ' 397' ' ' ASP . 13.8 m -130.42 17.37 2.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 108.841 -0.799 . . . . 0.0 108.841 178.148 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . 0.449 ' CB ' ' O ' ' B' ' 396' ' ' VAL . 0.5 OUTLIER 159.47 58.73 0.0 OUTLIER Pre-proline 0 N--CA 1.451 -0.387 0 CA-C-N 114.578 -1.192 . . . . 0.0 109.184 -179.322 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.508 ' HB3' " C4'" ' A' ' 5' ' ' ' U' . 0.9 OUTLIER -42.93 -52.02 5.01 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 123.65 2.9 . . . . 0.0 112.285 -179.769 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.533 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 1.0 OUTLIER -24.54 134.08 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.009 -0.996 . . . . 0.0 111.827 -179.431 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 38.9 t -138.81 151.05 46.71 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.984 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 1.097 HG23 HG23 ' B' ' 390' ' ' VAL . 0.3 OUTLIER -109.72 142.94 20.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.037 -179.946 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.863 HG21 ' O ' ' B' ' 423' ' ' ALA . 1.6 t -108.26 160.83 7.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.6 -179.097 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 0.791 ' CB ' HG23 ' B' ' 388' ' ' VAL . 2.4 mt-10 -131.37 116.28 17.35 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.725 179.166 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.584 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -102.11 107.05 18.01 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.358 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.547 ' HA ' ' O ' ' B' ' 410' ' ' THR . 22.9 ptt180 -144.2 165.21 28.5 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.671 -179.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.778 HG12 ' HG ' ' B' ' 385' ' ' LEU . 1.3 m -147.47 160.34 8.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.102 -179.036 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 65.84 2.71 13.09 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.905 -0.664 . . . . 0.0 113.414 179.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 7.3 t0 72.32 13.79 5.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.928 0.364 . . . . 0.0 111.16 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -157.43 14.63 0.3 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.243 -0.98 . . . . 0.0 113.488 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.547 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 2.5 m -133.83 121.4 21.74 Favored 'General case' 0 C--O 1.221 -0.434 0 CA-C-N 117.057 0.429 . . . . 0.0 111.478 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 19.1 t -106.47 102.83 14.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.61 0.243 . . . . 0.0 110.41 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.774 HD13 ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -61.24 -25.33 67.0 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.838 -0.431 . . . . 0.0 109.838 179.422 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . 0.418 ' C ' ' SG ' ' B' ' 404' ' ' CYS . . . 164.61 -163.7 36.39 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.401 -0.904 . . . . 0.0 112.56 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.441 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 3.5 t -160.34 159.75 31.58 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.982 0.42 . . . . 0.0 111.4 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.522 ' CA ' ' HD2' ' B' ' 426' ' ' ARG . . . -152.01 165.0 30.61 Favored Glycine 0 C--O 1.225 -0.443 0 C-N-CA 120.173 -1.013 . . . . 0.0 114.111 -179.144 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . 0.685 HG23 ' HB ' ' B' ' 401' ' ' ILE . 0.8 OUTLIER -152.76 144.91 15.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.396 -0.402 . . . . 0.0 111.412 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 1.021 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -155.98 177.16 33.2 Favored Glycine 0 C--N 1.329 0.187 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.133 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.467 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 9.2 ptm180 -88.23 -43.26 11.72 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.848 0.324 . . . . 0.0 111.72 -179.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.71 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.2 OUTLIER -99.25 34.18 2.23 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 179.719 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.744 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 48.85 -45.04 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 178.509 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.653 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.7 OUTLIER -42.72 -56.04 3.34 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 -179.817 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 1.021 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -47.66 -24.94 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 CA-C-O 121.476 0.655 . . . . 0.0 109.513 178.32 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.863 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -76.48 -49.57 16.22 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.838 -1.074 . . . . 0.0 108.108 176.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . 0.489 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -63.92 -52.57 44.02 Favored Glycine 0 N--CA 1.448 -0.519 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.247 179.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.8 HG23 ' HA ' ' B' ' 367' ' ' ASP . 1.5 mm -64.65 -69.27 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.742 0.306 . . . . 0.0 110.531 179.155 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.544 ' HB3' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -47.37 -25.53 1.04 Allowed 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.278 -178.9 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.737 ' HB2' ' O ' ' B' ' 423' ' ' ALA . . . -60.7 -59.09 5.93 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 107.675 -1.232 . . . . 0.0 107.675 176.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 0.859 ' O ' HD13 ' B' ' 432' ' ' LEU . . . -52.92 -48.73 67.03 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 107.79 -1.189 . . . . 0.0 107.79 177.23 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.66 ' HA ' HD21 ' B' ' 432' ' ' LEU . 1.9 tt0 -52.94 -17.84 1.64 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.732 178.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 10.4 m120 -85.25 -35.78 21.35 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.047 178.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.509 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -67.32 -36.31 81.2 Favored 'General case' 0 N--CA 1.461 0.116 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.733 -179.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.878 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -94.01 12.2 27.07 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.805 179.58 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -87.04 -12.61 46.81 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.25 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -112.47 93.55 4.49 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.881 0.372 . . . . 0.0 111.4 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.556 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 8.9 ptmm? -57.37 -50.78 71.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.38 179.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.556 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -51.73 -45.39 63.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.637 179.896 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.608 ' SD ' HD12 ' B' ' 412' ' ' LEU . 1.2 ttp -72.81 -46.69 51.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.113 0.482 . . . . 0.0 110.238 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.878 HD11 ' HA ' ' B' ' 432' ' ' LEU . 62.1 mt -53.98 -60.44 3.33 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.672 179.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . 0.415 ' O ' ' N ' ' B' ' 442' ' ' ALA . 22.4 t70 -54.43 -44.3 72.32 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.515 179.19 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.493 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.4 OUTLIER -43.49 -45.07 6.29 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 108.609 -0.885 . . . . 0.0 108.609 179.424 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.423 ' O ' ' C ' ' B' ' 442' ' ' ALA . 51.7 m-85 -64.65 -43.17 94.5 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.331 179.039 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . 0.456 ' O ' ' N ' ' B' ' 445' ' ' ARG . . . -42.32 -61.79 1.11 Allowed 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 178.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -48.86 -45.7 41.26 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 178.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.621 ' O ' HG23 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -65.19 -7.72 14.07 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.942 178.898 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.549 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -89.54 -44.18 10.29 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.374 179.441 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -82.37 -33.03 28.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.571 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . 0.428 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -60.71 -57.89 10.78 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.921 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.621 HG23 ' O ' ' B' ' 444' ' ' GLN . 12.7 pt -35.04 107.87 0.33 Allowed Pre-proline 0 N--CA 1.45 -0.454 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.899 179.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -82.84 126.08 4.4 Favored 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 123.046 2.498 . . . . 0.0 112.551 -179.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.51 47.57 1.19 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.058 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 42.37 65.19 0.95 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.073 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -77.74 -65.41 0.97 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.671 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . 0.415 ' OXT' ' OG ' ' B' ' 453' ' ' SER . 11.9 t . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.831 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.581 " O2'" " O5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.573 0 O4'-C1'-N19 111.388 3.188 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.717 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.136 0 O4'-C1'-N19 111.14 2.94 . 0.113 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.717 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.166 0 O4'-C1'-N19 111.077 2.877 . 0.448 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.62 " O2'" " C5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.247 0 C5'-C4'-C3' 111.325 -2.784 . 0.122 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.62 " C5'" " O2'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.041 0 O4'-C1'-N19 111.232 3.032 . 0.19 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.538 " O2'" " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.445 0 C3'-C2'-C1' 104.144 2.938 . 0.073 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.557 ' H6 ' " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.099 0 O4'-C1'-N19 111.429 3.229 . 0.138 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.63 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.236 0 C5'-C4'-C3' 111.57 -2.62 . 0.154 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.638 " O2'" " C5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.449 0 C5'-C4'-C3' 111.175 -2.884 . 0.124 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.638 " C5'" " O2'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -1.968 0 O4'-C1'-N19 111.185 2.985 . 0.021 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.621 " C5'" " O2'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.526 0 C5'-C4'-C3' 111.233 -2.845 . 0.044 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.748 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.034 0 O4'-C1'-N19 111.437 3.237 . 0.023 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.819 " O2'" " H5'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.149 0 O4'-C1'-N19 111.318 3.118 . 0.046 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.819 " H5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.545 0 C5'-C4'-C3' 111.203 -2.864 . 0.022 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.946 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.485 0 C5'-C4'-C3' 110.923 -3.051 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.946 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.433 -1.653 0 O4'-C1'-N19 111.62 3.42 . 0.241 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.891 " O5'" ' H8 ' ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.052 0 C3'-C2'-C1' 104.66 3.511 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.785 ' OP1' " H4'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.836 0 C5'-C4'-C3' 111.394 -2.737 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.661 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 1.992 0 O4'-C1'-N19 111.306 3.106 . 0.022 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.606 " H5'" " O2'" ' A' ' 19' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.554 0 C3'-C2'-C1' 104.887 3.763 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.587 " O2'" " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.258 0 C5'-C4'-C3' 111.056 -2.963 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.856 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.612 1.933 0 O4'-C1'-N19 111.0 2.8 . 0.037 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.801 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.445 0 O4'-C1'-N19 111.63 3.43 . 0.016 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.663 " C5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.265 0 C5'-C4'-C3' 111.367 -2.755 . 0.071 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . 0.407 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.438 2.035 0 O4'-C1'-N19 111.334 3.134 . 0.432 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.503 " H2'" ' C6 ' ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.349 0 O4'-C1'-N19 111.2 3.0 . 0.083 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.572 ' H6 ' " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.105 0 O4'-C1'-N19 110.996 2.796 . 0.21 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.591 " O2'" " O5'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.144 0 O4'-C1'-N19 111.219 3.019 . 0.127 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.591 " O5'" " O2'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.443 2.408 0 O4'-C1'-N19 110.984 2.784 . 0.143 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 0.588 ' C4 ' ' C4 ' ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.25 0 O4'-C1'-N19 111.31 3.11 . 0.212 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 0.588 ' C4 ' ' C4 ' ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.543 0 O4'-C1'-N19 111.489 3.289 . 0.191 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . 0.558 " O4'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.576 0 C5'-C4'-C3' 111.323 -2.784 . 0.14 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.226 0 N-CA-C 112.603 -0.199 . . . . 0.0 112.603 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . 0.515 ' O ' ' CG2' ' B' ' 425' ' ' ILE . 4.6 t 54.13 24.86 5.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.951 0.405 . . . . 0.0 110.891 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . 0.834 HD23 ' ND2' ' B' ' 369' ' ' ASN . 14.9 tp -37.12 126.07 0.96 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.219 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.518 ' CG ' HD12 ' B' ' 425' ' ' ILE . 21.5 t0 -58.29 -64.92 0.75 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.179 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.498 ' HA ' ' CE ' ' B' ' 371' ' ' LYS . 1.5 ttp -35.82 -44.05 0.33 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.615 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . 0.834 ' ND2' HD23 ' B' ' 366' ' ' LEU . 2.7 m-80 -60.99 -47.91 84.28 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.571 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 1.076 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -58.94 -70.59 0.14 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.626 179.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.498 ' CE ' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -36.22 -49.48 0.68 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.814 179.924 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.557 ' O ' ' CB ' ' B' ' 376' ' ' SER . 1.6 tmm_? -55.42 -38.44 68.98 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.508 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.547 ' O ' ' HB2' ' B' ' 377' ' ' LEU . 0.0 OUTLIER -65.58 -62.61 1.42 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.598 0.713 . . . . 0.0 110.425 179.175 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 0.67 HD13 ' OH ' ' B' ' 387' ' ' TYR . 1.0 OUTLIER -43.2 -70.77 0.1 Allowed 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -178.959 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -93.04 -20.83 20.16 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 114.483 1.29 . . . . 0.0 114.483 -176.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.557 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.6 OUTLIER -94.45 1.6 55.76 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 119.91 -0.716 . . . . 0.0 111.1 -179.525 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.547 ' HB2' ' O ' ' B' ' 373' ' ' GLN . 0.3 OUTLIER -134.68 -37.83 0.83 Allowed 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.663 178.218 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.488 HG23 ' CB ' ' B' ' 441' ' ' TYR . 0.8 OUTLIER -127.76 -149.33 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.898 179.284 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.485 ' H ' HG22 ' B' ' 378' ' ' ILE . . . 28.74 74.24 0.03 OUTLIER Glycine 0 C--N 1.332 0.338 0 C-N-CA 121.35 -0.452 . . . . 0.0 113.506 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.68 ' O ' ' HB2' ' B' ' 381' ' ' ALA . 13.7 p90 -100.12 -50.76 3.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.697 0.248 . . . . 0.0 111.176 179.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . 0.68 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 158.98 66.03 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.957 0.408 . . . . 0.0 111.079 179.753 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . 0.57 ' HB2' ' CZ ' ' B' ' 380' ' ' TYR . 7.0 t -171.91 -72.18 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.795 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.465 HD21 ' HA2' ' B' ' 379' ' ' GLY . 2.6 pt? -49.22 -26.41 2.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.248 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . 0.475 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 7.1 tpt180 68.56 70.87 0.29 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.101 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.695 ' HG ' HG12 ' B' ' 406' ' ' VAL . 10.5 tt -89.18 121.98 32.02 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 179.118 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . 0.514 ' O ' ' O ' ' B' ' 405' ' ' ARG . 2.5 p-80 -141.57 145.87 35.61 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.401 0.62 . . . . 0.0 112.584 -179.025 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.67 ' OH ' HD13 ' B' ' 374' ' ' LEU . 28.7 m-85 -99.43 151.85 20.64 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.363 178.156 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . 1.006 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -129.82 120.35 49.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.345 179.114 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.9 m -87.06 119.11 26.93 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.257 -179.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 0.998 HG23 HG23 ' B' ' 401' ' ' ILE . 34.0 m -126.75 151.94 34.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.132 179.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.582 ' CB ' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 73.81 111.72 0.07 Allowed 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -178.834 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.425 ' HA ' ' HD3' ' B' ' 393' ' ' PRO . 21.1 mttt -96.54 133.13 25.09 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 120.93 0.395 . . . . 0.0 111.281 -179.246 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.493 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 24.3 Cg_exo -62.22 166.04 13.64 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.631 2.22 . . . . 0.0 112.393 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . 0.487 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 64.4 p -150.64 173.88 13.63 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.459 179.178 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -85.92 15.02 5.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.192 0.52 . . . . 0.0 110.58 179.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 22.8 m -146.79 16.73 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.272 178.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 167.86 68.29 0.01 OUTLIER Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.111 -179.391 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.532 ' HB2' ' O ' ' B' ' 418' ' ' ARG . 14.2 Cg_endo -55.4 -42.86 64.04 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 123.237 2.625 . . . . 0.0 112.311 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.548 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 6.0 m-20 -20.07 124.17 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.671 -179.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -133.79 141.57 47.53 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.361 178.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 0.998 HG23 HG23 ' B' ' 390' ' ' VAL . 0.2 OUTLIER -114.05 138.46 43.86 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 CA-C-O 121.269 0.557 . . . . 0.0 111.376 -179.058 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.756 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.7 OUTLIER -105.11 166.7 3.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.433 -179.879 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 1.006 ' CB ' HG23 ' B' ' 388' ' ' VAL . 1.0 OUTLIER -133.8 112.59 11.46 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.045 0.45 . . . . 0.0 110.472 179.326 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.423 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -94.51 108.61 20.55 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.506 179.186 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.562 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.2 OUTLIER -150.3 169.28 21.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.151 0.501 . . . . 0.0 111.413 -179.439 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.695 HG12 ' HG ' ' B' ' 385' ' ' LEU . 1.2 m -144.59 145.21 21.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.775 -179.57 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 67.43 2.44 20.63 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.907 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . 0.499 ' HA ' ' HD3' ' B' ' 405' ' ' ARG . 16.5 t70 71.14 13.69 6.78 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.726 0.298 . . . . 0.0 111.066 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -137.11 -6.62 1.65 Allowed Glycine 0 CA--C 1.52 0.354 0 C-N-CA 120.395 -0.907 . . . . 0.0 113.6 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.562 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 95.3 m -127.03 119.71 27.28 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 117.15 0.475 . . . . 0.0 111.547 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . 0.514 ' HA ' ' HB2' ' B' ' 405' ' ' ARG . 41.5 t -102.89 97.09 5.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.171 0 CA-C-O 120.752 0.31 . . . . 0.0 110.75 179.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.757 HD13 ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -56.32 -22.48 30.92 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.696 -179.971 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 164.71 -165.66 37.6 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.405 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.683 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.0 OUTLIER -152.12 152.67 32.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.775 0.321 . . . . 0.0 110.732 -179.916 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.542 ' HA2' ' HG2' ' B' ' 426' ' ' ARG . . . -133.58 149.72 19.74 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 119.75 -1.214 . . . . 0.0 113.379 -179.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . 0.566 ' O ' HG13 ' B' ' 416' ' ' VAL . 3.8 p -148.26 118.88 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-O 120.776 0.322 . . . . 0.0 110.544 179.293 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.654 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -133.29 164.66 24.22 Favored Glycine 0 C--O 1.226 -0.347 0 C-N-CA 120.842 -0.694 . . . . 0.0 111.395 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.532 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.5 OUTLIER -79.88 -48.1 14.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 117.465 0.632 . . . . 0.0 111.316 -179.953 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.909 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.2 OUTLIER -74.41 -23.62 58.98 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.758 -0.201 . . . . 0.0 111.096 -179.651 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.909 HG23 ' O ' ' B' ' 419' ' ' ASN . 0.9 OUTLIER 102.87 -43.61 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 C-N-CA 124.299 1.04 . . . . 0.0 109.946 -178.374 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.628 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -49.92 -54.59 18.76 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.032 -1.47 . . . . 0.0 107.032 178.605 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.706 HD11 ' H ' ' B' ' 419' ' ' ASN . 0.1 OUTLIER -53.21 -14.48 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.515 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.89 177.935 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.762 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -84.06 -49.14 9.19 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 107.22 -1.4 . . . . 0.0 107.22 176.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . 0.616 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -60.88 -54.17 39.15 Favored Glycine 0 C--N 1.336 0.534 0 N-CA-C 109.883 -1.287 . . . . 0.0 109.883 177.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.518 HD12 ' CG ' ' B' ' 367' ' ' ASP . 8.9 mm -53.96 -68.28 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 177.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.593 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 2.6 tpt180 -39.93 -28.56 0.05 Allowed 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.101 179.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.616 ' HB3' ' O ' ' B' ' 424' ' ' GLY . . . -64.68 -55.1 22.22 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 177.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 1.076 ' CB ' ' HB1' ' B' ' 370' ' ' ALA . . . -59.84 -55.01 39.47 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 177.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.07 -11.92 0.53 Allowed 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.794 179.285 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.502 ' ND2' ' O ' ' B' ' 426' ' ' ARG . 1.4 m-80 -92.09 -32.04 15.31 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 177.668 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.439 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -71.93 -44.9 62.88 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.027 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.856 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.4 OUTLIER -85.1 11.1 10.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.015 -179.948 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . 0.514 ' O ' ' HG2' ' B' ' 433' ' ' ARG . 0.0 OUTLIER -80.27 -0.1 35.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.372 179.816 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.469 ' O ' ' HG ' ' B' ' 438' ' ' LEU . 31.3 t0 -130.09 93.17 3.43 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.747 179.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.58 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -58.24 -39.7 79.82 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.867 -179.832 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.58 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 9.8 mtpt -57.27 -41.64 80.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.767 0.318 . . . . 0.0 110.414 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.648 ' SD ' HD12 ' B' ' 412' ' ' LEU . 33.7 ttp -74.67 -48.43 26.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.169 0.509 . . . . 0.0 109.811 179.059 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.856 HD11 ' HA ' ' B' ' 432' ' ' LEU . 94.1 mt -53.94 -64.42 0.83 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.192 178.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -51.95 -45.25 64.29 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.245 -0.888 . . . . 0.0 109.93 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.574 ' CE1' ' HG3' ' B' ' 444' ' ' GLN . 0.1 OUTLIER -45.2 -38.59 5.48 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 179.561 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.548 ' CE1' ' CE2' ' B' ' 440' ' ' PHE . 25.6 m-85 -74.44 -39.64 62.44 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.061 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -52.15 -60.52 3.11 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 178.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 8.7 tttp -50.7 -44.4 57.98 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.206 -0.665 . . . . 0.0 109.206 178.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.757 ' O ' HG23 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -55.18 -50.75 68.57 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.028 178.787 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.615 ' HD2' ' CD1' ' B' ' 380' ' ' TYR . 7.8 mmp_? -51.69 -36.65 47.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.793 179.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -75.19 -41.14 58.53 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.956 0.408 . . . . 0.0 110.442 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . 0.458 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -65.99 -56.64 10.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.288 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.757 HG23 ' O ' ' B' ' 444' ' ' GLN . 1.1 pt -29.5 136.69 0.16 Allowed Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.723 179.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -48.1 167.44 0.1 Allowed 'Trans proline' 0 N--CA 1.464 -0.254 0 C-N-CA 122.995 2.463 . . . . 0.0 112.427 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . 0.411 ' O ' ' O ' ' B' ' 451' ' ' SER . 42.4 mtt-85 -105.67 87.11 2.52 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.946 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . 0.411 ' O ' ' O ' ' B' ' 450' ' ' ARG . 1.7 m -49.38 -179.87 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.716 179.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -170.01 39.13 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.096 -179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.915 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.805 " O2'" ' H8 ' ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.777 0 O4'-C1'-N19 111.493 3.293 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.805 ' H8 ' " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.438 1.989 0 O4'-C1'-N19 111.215 3.015 . 0.2 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.684 HO2' " C5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.78 1 C3'-C2'-C1' 105.105 4.006 OUTLIER-DELTA 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.684 " C5'" HO2' ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.14 0 O4'-C1'-N19 111.303 3.103 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.762 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.115 0 O4'-C1'-N19 111.178 2.978 . 0.045 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.491 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.269 0 O4'-C1'-N19 111.04 2.84 . 0.143 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.676 ' H6 ' " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.039 0 O4'-C1'-N19 111.495 3.295 . 0.192 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.669 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.226 0 O4'-C1'-N19 110.988 2.788 . 0.322 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.669 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.403 0 C5'-C4'-C3' 111.364 -2.757 . 0.416 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.528 ' H6 ' " O5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 P--O5' 1.612 1.939 0 O4'-C1'-N19 111.198 2.998 . 0.081 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.632 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.165 0 O4'-C1'-N19 111.192 2.992 . 0.022 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.914 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 P--O5' 1.612 1.881 0 O4'-C1'-N19 111.066 2.866 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.914 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.599 0 C3'-C2'-C1' 104.565 3.405 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.748 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.597 0 C3'-C2'-C1' 104.273 3.081 . 0.181 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.748 " O4'" " H2'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.431 -1.812 0 C5'-C4'-C3' 111.036 -2.976 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.591 ' C8 ' ' C5 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.778 0 C5'-C4'-C3' 110.857 -3.095 . 0.384 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.607 " O2'" " C1'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.448 0 O4'-C1'-N19 111.194 2.994 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.641 ' N6 ' ' N3 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.432 -1.771 0 C5'-C4'-C3' 111.014 -2.991 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.546 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.238 0 O4'-C1'-N19 111.171 2.971 . 0.28 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.771 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.934 0 C5'-C4'-C3' 111.202 -2.865 . 0.131 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.771 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.395 0 O4'-C1'-N19 111.269 3.069 . 0.063 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.912 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.612 1.94 0 C5'-C4'-C3' 111.302 -2.799 . 0.015 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.785 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.254 0 O4'-C1'-N19 111.818 3.618 . 0.032 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.785 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 P--O5' 1.615 2.204 0 O4'-C1'-N19 110.863 2.663 . 0.125 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . 0.43 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.185 0 O4'-C1'-N19 111.238 3.038 . 0.165 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.56 HO2' " C5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.695 0 C5'-C4'-C3' 111.307 -2.795 . 0.098 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.835 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.138 0 C5'-C4'-C3' 111.353 -2.764 . 0.148 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.835 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.483 0 C3'-C2'-C1' 104.585 3.428 . 0.031 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.872 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.442 2.314 0 O4'-C1'-N19 111.202 3.002 . 0.191 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 0.877 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.279 0 O4'-C1'-N19 111.214 3.014 . 0.233 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 0.877 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.592 0 C3'-C2'-C1' 104.305 3.116 . 0.093 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . 0.493 " O4'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.556 0 C5'-C4'-C3' 111.271 -2.82 . 0.219 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . 0.504 ' O ' ' N ' ' B' ' 366' ' ' LEU . . . . . . . . 0 N--CA 1.49 2.255 0 N-CA-C 112.545 -0.222 . . . . 0.0 112.545 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 1.7 m -60.57 73.91 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.696 0.284 . . . . 0.0 110.902 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . 0.504 ' N ' ' O ' ' B' ' 364' ' ' GLY . 0.2 OUTLIER -129.81 120.54 25.17 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.886 0.374 . . . . 0.0 111.223 -179.698 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.523 ' CB ' HG13 ' B' ' 425' ' ' ILE . 0.0 OUTLIER -55.42 -71.08 0.09 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.601 179.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.434 ' HE3' ' HB3' ' B' ' 368' ' ' MET . 3.3 tmm? -35.72 -43.79 0.3 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.999 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . 0.463 ' HB2' ' HB3' ' B' ' 366' ' ' LEU . 87.1 m-20 -65.31 -42.9 92.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.896 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 0.806 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -62.76 -71.94 0.15 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.448 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.566 ' HG2' " O2'" ' A' ' 20' ' ' ' A' . 0.0 OUTLIER -35.82 -49.45 0.61 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.968 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.572 ' O ' ' CB ' ' B' ' 376' ' ' SER . 3.5 tmm_? -58.39 -37.03 74.45 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.924 0.393 . . . . 0.0 110.71 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.548 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -62.34 -48.61 79.05 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.219 0.533 . . . . 0.0 110.973 179.259 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 0.925 HD13 ' OH ' ' B' ' 387' ' ' TYR . 0.4 OUTLIER -62.42 -69.06 0.28 Allowed 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -178.127 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . 0.426 ' CG ' " H5'" ' A' ' 20' ' ' ' A' . 6.2 m-85 -70.83 -40.2 72.56 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -177.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.572 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.5 OUTLIER -71.9 -51.63 21.24 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.227 0.455 . . . . 0.0 112.227 -178.642 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.624 ' O ' HD13 ' B' ' 378' ' ' ILE . 2.3 mm? -89.32 -23.25 22.31 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 114.733 1.383 . . . . 0.0 114.733 -176.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.624 HD13 ' O ' ' B' ' 377' ' ' LEU . 20.8 mm -127.82 -74.77 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.234 0 CA-C-N 119.219 0.918 . . . . 0.0 113.429 -178.018 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.562 ' N ' ' O ' ' B' ' 374' ' ' LEU . . . -51.61 80.43 0.01 OUTLIER Glycine 0 N--CA 1.453 -0.176 0 CA-C-N 116.188 -0.46 . . . . 0.0 113.433 -178.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.95 ' OH ' HG21 ' B' ' 448' ' ' ILE . 14.5 p90 -102.05 173.18 6.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.757 0.313 . . . . 0.0 111.117 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . 0.442 ' C ' ' O ' ' B' ' 380' ' ' TYR . . . -28.07 -43.03 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.193 -179.281 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . 0.637 ' O ' ' CE1' ' B' ' 380' ' ' TYR . 0.5 OUTLIER -114.39 132.34 56.26 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.839 -179.945 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.971 HD11 ' HB2' ' B' ' 385' ' ' LEU . 0.1 OUTLIER 151.31 -49.74 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.936 0.398 . . . . 0.0 110.479 -179.871 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . 0.743 ' N ' HD13 ' B' ' 383' ' ' LEU . 0.0 OUTLIER 69.88 73.75 0.23 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.064 178.708 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.971 ' HB2' HD11 ' B' ' 383' ' ' LEU . 6.0 tt -102.71 128.8 49.27 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 179.107 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . 0.478 ' O ' ' O ' ' B' ' 405' ' ' ARG . 14.9 p-80 -141.32 144.96 34.88 Favored 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 121.48 0.657 . . . . 0.0 112.761 -179.038 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.925 ' OH ' HD13 ' B' ' 374' ' ' LEU . 27.4 m-85 -103.06 145.93 29.15 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.748 178.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . 0.739 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -129.08 122.23 55.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.128 179.211 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.7 m -85.5 122.52 29.75 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.555 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 0.574 HG23 ' CG2' ' B' ' 401' ' ' ILE . 35.7 m -130.25 154.28 40.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.549 -179.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.555 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 9.0 tptt 95.07 23.01 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.326 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.532 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER 3.62 114.11 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.696 0 O-C-N 123.979 0.799 . . . . 0.0 112.192 179.931 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.47 ' HG3' ' HB2' ' B' ' 400' ' ' SER . 34.5 Cg_exo -55.2 163.64 4.41 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.525 2.15 . . . . 0.0 113.226 -179.17 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . 0.473 ' CG2' ' OD1' ' B' ' 397' ' ' ASP . 0.1 OUTLIER -131.33 177.22 7.64 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.706 -1.133 . . . . 0.0 111.738 -179.288 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -102.08 18.0 21.87 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.565 179.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . 0.499 ' O ' ' HB3' ' B' ' 397' ' ' ASP . 10.1 m -137.4 6.57 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.984 178.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . 0.499 ' HB3' ' O ' ' B' ' 396' ' ' VAL . 17.8 p-10 172.79 54.17 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.243 0 CA-C-N 114.954 -1.021 . . . . 0.0 109.384 -179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.464 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 93.1 Cg_exo -33.34 -29.18 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.613 2.875 . . . . 0.0 113.566 -179.161 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.559 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 1.1 p-10 -31.65 125.41 0.24 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.189 0.519 . . . . 0.0 111.854 -178.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . 0.47 ' HB2' ' HG3' ' B' ' 393' ' ' PRO . 29.1 t -133.92 157.01 47.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.914 -179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 0.574 ' CG2' HG23 ' B' ' 390' ' ' VAL . 4.6 tt -114.85 151.58 16.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.14 0.495 . . . . 0.0 111.037 -179.723 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.681 ' O ' HG22 ' B' ' 414' ' ' THR . 0.4 OUTLIER -116.14 158.59 16.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.14 -178.971 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 0.739 ' CB ' HG23 ' B' ' 388' ' ' VAL . 3.6 mm-40 -122.79 118.37 27.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.884 179.012 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.666 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 8.9 t -96.77 100.04 11.6 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 179.056 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.651 ' HA ' ' O ' ' B' ' 410' ' ' THR . 13.1 ttp180 -140.35 162.73 34.59 Favored 'General case' 0 N--CA 1.452 -0.375 0 CA-C-O 121.033 0.444 . . . . 0.0 111.53 -179.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.654 HG12 ' HG ' ' B' ' 385' ' ' LEU . 2.0 m -146.5 -178.54 0.71 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.441 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.44 -179.328 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 58.86 -101.48 0.22 Allowed Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.914 179.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -156.95 18.37 0.31 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.874 0.368 . . . . 0.0 110.965 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 165.03 37.35 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.937 -0.649 . . . . 0.0 111.942 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.651 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 17.4 m -122.96 114.73 20.82 Favored 'General case' 0 C--O 1.217 -0.644 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . 0.485 HG22 ' HB2' ' B' ' 405' ' ' ARG . 47.1 t -107.33 107.79 23.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.581 0.229 . . . . 0.0 111.047 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.653 HD21 HG13 ' B' ' 406' ' ' VAL . 0.6 OUTLIER -66.91 -27.87 67.85 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 179.324 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . 0.53 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 167.26 -168.19 40.3 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.211 -0.995 . . . . 0.0 113.004 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.681 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.0 OUTLIER -145.58 155.97 43.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.697 0.284 . . . . 0.0 111.211 -179.364 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.545 ' O ' ' CG1' ' B' ' 401' ' ' ILE . . . -148.3 151.89 24.03 Favored Glycine 0 C--O 1.223 -0.564 0 C-N-CA 120.227 -0.987 . . . . 0.0 113.22 -179.477 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . 0.412 ' HB ' HG13 ' B' ' 401' ' ' ILE . 3.5 p -139.12 148.86 23.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 120.731 0.301 . . . . 0.0 110.978 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.825 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -160.53 152.59 23.35 Favored Glycine 0 C--O 1.228 -0.24 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.16 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.422 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 0.0 OUTLIER -68.81 -44.5 73.4 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.378 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.798 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.3 OUTLIER -98.05 32.08 2.52 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.185 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.724 ' C ' HD12 ' B' ' 420' ' ' ILE . 0.4 OUTLIER 51.55 -47.43 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 178.59 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.635 ' N ' HD12 ' B' ' 420' ' ' ILE . 0.0 OUTLIER -44.91 -54.79 6.09 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 -179.577 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.825 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -50.39 -19.34 0.71 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.527 0 N-CA-C 109.9 -0.408 . . . . 0.0 109.9 178.486 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.663 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -83.23 -48.37 10.55 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 177.124 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . 0.711 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -59.78 -52.36 53.42 Favored Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 109.747 -1.341 . . . . 0.0 109.747 177.666 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.523 HG13 ' CB ' ' B' ' 367' ' ' ASP . 0.5 OUTLIER -57.61 -67.17 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 177.329 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.615 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 10.8 tpt180 -39.81 -30.19 0.08 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.096 178.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.711 ' HB3' ' O ' ' B' ' 424' ' ' GLY . . . -60.71 -61.42 2.6 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 0.806 ' CB ' ' HB1' ' B' ' 370' ' ' ALA . . . -53.23 -49.84 66.0 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 177.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.589 ' HA ' HD21 ' B' ' 432' ' ' LEU . 1.4 tt0 -47.51 -24.54 0.87 Allowed 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.431 178.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.53 ' HB3' ' HA3' ' B' ' 413' ' ' GLY . 14.2 m120 -81.71 -34.63 30.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.65 179.469 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.666 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -69.84 -42.28 73.79 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.966 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -83.66 9.62 11.2 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.889 -0.324 . . . . 0.0 111.408 -179.507 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . 0.453 ' HD2' ' HA ' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -88.68 -9.75 50.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.163 -179.587 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.5 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 76.7 m-20 -108.91 83.51 1.77 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.239 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.543 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 4.6 ptmm? -50.77 -53.38 32.22 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.027 179.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.543 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 10.0 mtpp -52.48 -43.98 65.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.736 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.5 ' HB3' ' CB ' ' B' ' 434' ' ' ASP . 14.3 tmm? -70.08 -50.52 40.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.964 0.412 . . . . 0.0 110.252 179.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.966 HD11 ' HA ' ' B' ' 432' ' ' LEU . 85.6 mt -52.77 -61.98 1.94 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.398 179.326 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 35.4 t0 -56.42 -44.13 80.08 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.032 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.45 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -42.29 -44.73 3.95 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.466 -0.788 . . . . 0.0 108.908 179.641 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.46 ' O ' ' HG2' ' B' ' 445' ' ' ARG . 49.9 m-85 -67.94 -44.49 76.71 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.62 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . 0.409 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -44.5 -60.54 1.92 Allowed 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.369 -0.975 . . . . 0.0 108.369 178.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 11.2 ttmt -47.76 -38.93 16.57 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.652 -0.703 . . . . 0.0 109.219 178.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.667 ' O ' HG23 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -61.3 -51.32 69.38 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 178.512 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.635 ' N ' ' HG3' ' B' ' 444' ' ' GLN . 0.3 OUTLIER -44.11 -43.95 7.26 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.993 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -80.59 -36.21 33.13 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.189 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . 0.46 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -63.31 -61.73 2.16 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.95 HG21 ' OH ' ' B' ' 380' ' ' TYR . 1.3 pt -28.16 139.74 0.09 OUTLIER Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.798 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . 0.436 ' O ' ' C ' ' B' ' 450' ' ' ARG . 96.5 Cg_endo -78.07 5.34 5.45 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.861 2.374 . . . . 0.0 112.359 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . 0.436 ' C ' ' O ' ' B' ' 449' ' ' PRO . 22.5 ptt180 33.1 49.59 0.19 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.303 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -166.27 160.12 15.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.027 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . 0.406 ' O ' ' CB ' ' B' ' 453' ' ' SER . 1.9 tm-20 -150.81 116.32 5.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.979 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . 0.406 ' CB ' ' O ' ' B' ' 452' ' ' GLU . 1.6 m . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.981 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.576 ' H8 ' HO5' ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.437 1.906 0 C5'-C4'-C3' 110.976 -3.016 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.968 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.331 0 O4'-C1'-N19 111.26 3.06 . 0.234 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.968 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.17 0 O4'-C1'-N19 111.277 3.077 . 0.188 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.585 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.355 0 C5'-C4'-C3' 111.272 -2.819 . 0.053 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.695 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 P--O5' 1.613 1.976 0 O4'-C1'-N19 111.093 2.893 . 0.028 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.526 " O2'" " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.481 0 C5'-C4'-C3' 111.211 -2.859 . 0.088 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.699 ' H6 ' " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.928 0 O4'-C1'-N19 111.491 3.291 . 0.077 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.695 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.091 0 C5'-C4'-C3' 111.36 -2.76 . 0.087 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.695 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.579 0 C5'-C4'-C3' 111.073 -2.951 . 0.16 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.629 " C5'" " O2'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.342 0 C5'-C4'-C3' 110.97 -3.02 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.643 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.341 0 O4'-C1'-N19 111.369 3.169 . 0.033 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.987 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 P--O5' 1.614 2.06 0 O4'-C1'-N19 111.258 3.058 . 0.014 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.987 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.678 0 C3'-C2'-C1' 104.734 3.593 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.713 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.565 0 O4'-C1'-N19 111.592 3.392 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.713 " O4'" " H2'" ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.429 -1.983 0 C5'-C4'-C3' 111.087 -2.942 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.686 ' C8 ' ' C5 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.609 1.628 0 O4'-C1'-N19 111.386 3.186 . 0.128 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.715 " O2'" ' P ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.432 -1.753 0 O4'-C1'-N19 111.418 3.218 OUTLIER-EPSILON 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.719 " H2'" " O4'" ' A' ' 19' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.077 0 C5'-C4'-C3' 111.122 -2.918 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.719 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.142 0 O4'-C1'-N19 111.532 3.332 . 0.092 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.839 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.956 0 C5'-C4'-C3' 111.127 -2.915 . 0.178 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.839 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.515 0 C5'-C4'-C3' 111.085 -2.943 . 0.012 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.902 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.612 1.851 0 O4'-C1'-N19 111.244 3.044 . 0.017 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.672 " O2'" " C5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.167 0 O4'-C1'-N19 111.858 3.658 . 0.013 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.708 ' H6 ' " O5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.224 0 C5'-C4'-C3' 111.353 -2.765 . 0.059 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . 0.485 ' O6 ' ' O4 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.223 0 O4'-C1'-N19 111.324 3.124 . 0.616 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.497 " H2'" ' C6 ' ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.617 0 O4'-C1'-N19 111.087 2.887 . 0.083 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.784 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.012 0 C5'-C4'-C3' 111.234 -2.844 . 0.116 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.784 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.589 1 C3'-C2'-C1' 105.196 4.107 OUTLIER-DELTA 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.887 " H2'" " O4'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.043 0 O4'-C1'-N19 111.137 2.937 . 0.01 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 0.919 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.22 0 O4'-C1'-N19 111.556 3.356 . 0.131 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 0.919 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.726 0 C3'-C2'-C1' 104.643 3.492 . 0.045 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . 0.644 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.33 0 C5'-C4'-C3' 111.097 -2.935 . 0.268 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.248 0 N-CA-C 112.554 -0.218 . . . . 0.0 112.554 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . 0.409 ' O ' ' OG ' ' B' ' 365' ' ' SER . 14.6 p -74.8 65.14 1.33 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.869 0.366 . . . . 0.0 110.894 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . 0.491 HD12 ' HA ' ' B' ' 366' ' ' LEU . 6.1 tp -114.08 13.43 18.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.369 0.604 . . . . 0.0 110.79 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.664 ' HB3' HD12 ' B' ' 425' ' ' ILE . 0.2 OUTLIER -44.75 -75.14 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.99 179.396 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.42 ' C ' ' O ' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -36.15 -44.2 0.38 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.666 179.779 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . 0.472 ' HB2' ' HG ' ' B' ' 366' ' ' LEU . 7.7 m120 -66.49 -38.36 87.11 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.921 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 0.927 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -61.31 -70.45 0.19 Allowed 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 178.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.556 ' HB3' " O2'" ' A' ' 20' ' ' ' A' . 0.0 OUTLIER -39.07 -42.17 0.88 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.061 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.559 ' O ' ' CB ' ' B' ' 376' ' ' SER . 3.0 tmt_? -53.49 -43.28 68.1 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.73 179.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.546 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -64.43 -60.93 2.58 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.485 179.212 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 0.658 HD23 ' N ' ' B' ' 374' ' ' LEU . 0.7 OUTLIER -45.8 -74.4 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.988 1.107 . . . . 0.0 113.988 -178.474 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . 0.426 ' HB2' " C5'" ' A' ' 20' ' ' ' A' . 3.8 m-30 -95.56 -4.7 44.21 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -176.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.559 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -108.84 1.15 20.7 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.044 -0.662 . . . . 0.0 110.337 179.017 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.723 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.2 OUTLIER -133.88 -40.16 0.86 Allowed 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 178.215 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.723 HD13 ' O ' ' B' ' 377' ' ' LEU . 2.1 mm -129.37 -144.88 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 CA-C-N 115.36 -0.836 . . . . 0.0 109.609 179.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.479 ' H ' HG22 ' B' ' 378' ' ' ILE . . . 40.65 66.61 0.83 Allowed Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.993 -0.622 . . . . 0.0 113.701 179.026 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.676 ' O ' ' HB3' ' B' ' 381' ' ' ALA . 30.9 p90 -77.12 -4.03 42.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.802 0.301 . . . . 0.0 110.569 179.04 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . 0.676 ' HB3' ' O ' ' B' ' 380' ' ' TYR . . . 95.15 -38.53 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 178.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . 0.443 ' HB3' ' CD2' ' B' ' 380' ' ' TYR . 11.1 t -86.59 24.9 1.33 Allowed 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -179.172 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.646 HD12 ' CE1' ' B' ' 441' ' ' TYR . 0.4 OUTLIER -114.31 -5.8 12.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.699 0.285 . . . . 0.0 111.064 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . 0.501 ' O ' HG12 ' B' ' 406' ' ' VAL . 14.5 tpp180 63.68 59.14 1.2 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.994 0.426 . . . . 0.0 110.693 -179.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.613 ' HA ' HG12 ' B' ' 406' ' ' VAL . 7.8 tt -114.43 133.11 55.97 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.907 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . 0.595 ' N ' HD23 ' B' ' 385' ' ' LEU . 6.2 p-80 -158.85 160.73 36.51 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.631 0.729 . . . . 0.0 112.785 -179.078 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.615 ' CE2' ' HB1' ' B' ' 427' ' ' ALA . 8.0 m-85 -108.09 145.72 33.65 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.624 -1.171 . . . . 0.0 110.511 178.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . 0.461 HG23 ' HB2' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -127.86 125.56 65.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.536 179.108 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.6 m -86.14 123.87 31.91 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.499 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 1.009 HG23 HG23 ' B' ' 401' ' ' ILE . 19.6 m -129.89 156.97 42.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.01 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.84 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 86.49 19.9 0.08 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.036 179.868 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.509 ' C ' ' O ' ' B' ' 391' ' ' LYS . 1.3 mmmt -2.76 122.66 0.0 OUTLIER Pre-proline 0 N--CA 1.471 0.616 0 O-C-N 124.194 0.934 . . . . 0.0 112.551 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.526 ' HB2' " O2'" ' A' ' 5' ' ' ' U' . 12.4 Cg_exo -66.24 157.48 59.76 Favored 'Trans proline' 0 N--CA 1.464 -0.24 0 C-N-CA 122.695 2.263 . . . . 0.0 113.282 -179.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . 0.463 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 0.3 OUTLIER -148.64 166.34 28.63 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.798 -1.092 . . . . 0.0 111.472 -179.764 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -82.69 10.13 8.16 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-O 121.089 0.471 . . . . 0.0 110.812 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . 0.563 HG12 " O2'" ' A' ' 30' ' ' ' C' . 27.2 m -132.67 15.04 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 165.73 57.46 0.0 OUTLIER Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 114.581 -1.19 . . . . 0.0 109.335 -179.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.512 ' HB3' " O4'" ' A' ' 5' ' ' ' U' . 1.0 OUTLIER -42.95 -54.64 3.24 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 123.483 2.789 . . . . 0.0 111.715 179.981 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.531 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 6.7 m120 -19.54 130.51 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.837 -1.074 . . . . 0.0 112.002 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -140.25 150.49 44.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.898 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 1.009 HG23 HG23 ' B' ' 390' ' ' VAL . 0.5 OUTLIER -115.44 143.98 24.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.985 -179.714 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.636 HG23 ' HB1' ' B' ' 423' ' ' ALA . 1.5 t -108.65 159.62 7.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.949 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 0.461 ' HB2' HG23 ' B' ' 388' ' ' VAL . 0.9 OUTLIER -134.03 123.35 24.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.442 179.568 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.533 ' O ' ' N ' ' B' ' 412' ' ' LEU . 0.1 OUTLIER -111.08 113.04 25.27 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 179.27 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.592 ' HA ' ' O ' ' B' ' 410' ' ' THR . 3.1 ptt180 -141.26 171.73 13.67 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 123.389 0.431 . . . . 0.0 111.675 -179.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.668 HG23 ' HB ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -139.32 166.7 21.18 Favored 'Isoleucine or valine' 0 C--O 1.239 0.536 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.383 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . 0.592 ' O ' ' CB ' ' B' ' 408' ' ' ASP . . . -45.26 103.3 0.05 OUTLIER Glycine 0 C--N 1.338 0.686 0 CA-C-N 114.879 -1.055 . . . . 0.0 113.335 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . 0.592 ' CB ' ' O ' ' B' ' 407' ' ' GLY . 3.8 t70 137.21 -9.14 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 123.796 0.838 . . . . 0.0 109.745 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 88.81 19.04 53.14 Favored Glycine 0 N--CA 1.442 -0.904 0 N-CA-C 110.876 -0.89 . . . . 0.0 110.876 -179.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.668 ' HB ' HG23 ' B' ' 406' ' ' VAL . 34.7 m -82.49 125.49 31.16 Favored 'General case' 0 C--O 1.221 -0.42 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 26.8 t -103.09 110.79 30.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 120.678 0.275 . . . . 0.0 110.301 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.843 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.3 OUTLIER -64.07 -28.91 70.11 Favored 'General case' 0 CA--C 1.515 -0.37 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.286 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 167.58 -169.03 40.95 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.162 -1.018 . . . . 0.0 112.749 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.529 ' OG1' HD11 ' B' ' 401' ' ' ILE . 3.5 t -156.0 148.76 24.04 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.909 0.385 . . . . 0.0 110.949 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.539 ' HA2' ' HG2' ' B' ' 426' ' ' ARG . . . -131.6 162.42 23.75 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.261 -0.971 . . . . 0.0 113.279 -179.569 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . 0.413 ' HB ' HD12 ' B' ' 401' ' ' ILE . 3.5 p -142.57 150.4 18.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.689 -0.256 . . . . 0.0 110.731 -179.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.89 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -172.57 150.0 12.18 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.165 -1.017 . . . . 0.0 113.008 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.418 ' HA ' ' CG ' ' B' ' 399' ' ' ASN . 0.0 OUTLIER -69.73 -43.28 72.64 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 120.822 0.344 . . . . 0.0 111.894 -179.701 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.728 ' H ' HD11 ' B' ' 422' ' ' ILE . 6.0 t30 -97.06 29.19 3.21 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.69 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 51.38 -45.43 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 114.646 1.35 . . . . 0.0 114.646 178.401 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.647 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -43.95 -54.36 5.43 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 -179.92 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.89 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -48.07 -21.04 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.057 178.551 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.69 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -83.57 -47.71 11.02 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 177.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . 0.686 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -59.63 -52.23 54.28 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 110.136 -1.186 . . . . 0.0 110.136 177.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.664 HD12 ' HB3' ' B' ' 367' ' ' ASP . 4.8 mm -58.46 -67.15 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 177.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.579 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 24.2 tpt180 -38.01 -31.31 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.186 178.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.686 ' HB3' ' O ' ' B' ' 424' ' ' GLY . . . -62.93 -57.59 10.27 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 178.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 0.927 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -55.76 -52.39 64.12 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.67 178.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.48 ' OE2' ' HB2' ' B' ' 370' ' ' ALA . 0.7 OUTLIER -56.63 -18.25 11.43 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.866 -0.607 . . . . 0.0 110.706 179.369 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.512 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.9 OUTLIER -79.85 -40.8 27.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.407 178.862 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.487 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -67.46 -35.03 78.39 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.376 -179.317 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.7 ' HA ' HD21 ' B' ' 438' ' ' LEU . 0.2 OUTLIER -86.98 10.96 14.77 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.682 179.786 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 5.0 ptm180 -85.0 -9.07 58.42 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.079 -179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.544 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 62.7 m-20 -115.65 80.01 1.38 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.021 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.563 ' HA ' HD12 ' B' ' 438' ' ' LEU . 7.7 ptpt -48.92 -53.03 21.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.846 0.355 . . . . 0.0 110.278 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.55 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.2 OUTLIER -53.19 -42.42 66.22 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.551 179.809 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.843 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.8 OUTLIER -71.12 -45.77 62.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.24 0.543 . . . . 0.0 109.598 179.085 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.7 HD21 ' HA ' ' B' ' 432' ' ' LEU . 76.9 mt -52.64 -59.88 3.93 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.461 178.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -56.6 -44.26 80.93 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.007 -0.997 . . . . 0.0 109.718 178.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.524 ' CD1' ' C ' ' B' ' 440' ' ' PHE . 0.2 OUTLIER -43.38 -43.95 5.41 Favored 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.564 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.646 ' CE1' HD12 ' B' ' 383' ' ' LEU . 49.7 m-85 -66.37 -46.12 77.78 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.287 -0.87 . . . . 0.0 110.47 179.226 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . 0.441 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -42.27 -60.64 1.4 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 178.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -49.09 -47.43 45.16 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.528 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -52.75 -58.78 5.75 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.485 179.157 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.558 ' HG2' ' CD1' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -42.73 -38.78 2.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.68 179.504 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -74.63 -36.8 62.91 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.637 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . 0.461 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -65.84 -63.15 1.15 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.446 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.496 HG13 ' O ' ' B' ' 445' ' ' ARG . 1.2 pp -29.39 119.02 0.29 Allowed Pre-proline 0 C--N 1.328 -0.366 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.574 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . 0.498 ' O ' ' HB2' ' B' ' 450' ' ' ARG . 95.2 Cg_exo -44.98 -48.5 10.85 Favored 'Trans proline' 0 N--CA 1.464 -0.212 0 C-N-CA 122.862 2.374 . . . . 0.0 112.563 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . 0.498 ' HB2' ' O ' ' B' ' 449' ' ' PRO . 2.9 ttt-85 170.49 -67.59 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.014 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 77.9 p -118.93 -169.0 1.65 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.062 -179.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -122.89 179.04 4.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.886 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.899 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.898 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.434 1.677 0 O4'-C1'-N19 111.335 3.135 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.898 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.443 2.407 0 O4'-C1'-N19 111.335 3.135 . 0.207 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.584 HO2' " C5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.436 0 O4'-C1'-N19 111.116 2.916 . 0.212 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.671 ' C6 ' ' C4 ' ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.038 0 O4'-C1'-N19 110.909 2.709 . 0.144 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.671 ' C4 ' ' C6 ' ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.078 0 O4'-C1'-N19 111.289 3.089 . 0.427 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.509 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.429 -2.026 0 O4'-C1'-N19 111.088 2.888 . 0.043 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.683 ' H6 ' " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.998 0 O4'-C1'-N19 111.25 3.05 . 0.112 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.59 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.217 0 O4'-C1'-N19 110.965 2.765 . 0.188 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.59 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.426 -2.253 0 O4'-C1'-N19 111.152 2.952 . 0.075 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.735 ' H6 ' " O5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 P--O5' 1.611 1.792 0 C5'-C4'-C3' 110.994 -3.004 . 0.084 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.616 " C5'" " O2'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.366 0 C5'-C4'-C3' 111.263 -2.825 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.788 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.435 1.745 0 C5'-C4'-C3' 110.987 -3.009 . 0.073 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.788 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.547 0 C3'-C2'-C1' 104.739 3.599 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.646 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.331 0 O4'-C1'-N19 111.226 3.026 . 0.112 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.83 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.43 -1.919 0 C5'-C4'-C3' 110.945 -3.037 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.83 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.431 -1.801 0 O4'-C1'-N19 111.318 3.118 . 0.286 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.491 " H2'" ' C4 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.302 0 C5'-C4'-C3' 110.848 -3.102 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.661 ' N6 ' ' N3 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.656 0 C5'-C4'-C3' 110.869 -3.088 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.656 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.303 0 C5'-C4'-C3' 111.174 -2.884 . 0.263 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.565 " O4'" " O2'" ' A' ' 19' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.436 1.809 0 C5'-C4'-C3' 110.906 -3.062 . 0.238 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.833 HO2' ' H6 ' ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.49 0 C3'-C2'-C1' 104.293 3.103 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.878 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.042 0 O4'-C1'-N19 111.183 2.983 . 0.014 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.587 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.428 -2.109 0 O4'-C1'-N19 111.695 3.495 . 0.056 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.856 ' H6 ' " O5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.082 0 C5'-C4'-C3' 111.526 -2.649 . 0.076 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.44 2.173 0 O4'-C1'-N19 111.144 2.944 . 0.265 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.483 " H2'" ' C6 ' ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.189 0 O4'-C1'-N19 111.235 3.035 . 0.125 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.632 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 1.967 0 O4'-C1'-N19 111.053 2.853 . 0.416 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.632 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.432 0 C3'-C2'-C1' 104.271 3.079 . 0.058 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 1.028 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.247 0 O4'-C1'-N19 111.055 2.855 . 0.123 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 1.028 " H5'" " O2'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.249 0 O4'-C1'-N19 111.435 3.235 . 0.176 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 0.929 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.42 -2.76 0 O4'-C1'-N19 111.243 3.043 . 0.1 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . 0.499 " C5'" HO2' ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.569 0 C5'-C4'-C3' 111.251 -2.833 . 0.134 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . 0.527 ' O ' ' CB ' ' B' ' 365' ' ' SER . . . . . . . . 0 N--CA 1.489 2.173 0 N-CA-C 112.536 -0.226 . . . . 0.0 112.536 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . 0.527 ' CB ' ' O ' ' B' ' 364' ' ' GLY . 1.0 OUTLIER 86.27 27.42 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.868 0.366 . . . . 0.0 110.996 179.949 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . 0.702 HD12 ' ND2' ' B' ' 369' ' ' ASN . 2.2 tp -89.52 3.76 51.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.374 0.606 . . . . 0.0 111.26 179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.827 ' HB3' HG23 ' B' ' 425' ' ' ILE . 0.0 OUTLIER -38.27 -72.7 0.06 Allowed 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.625 179.015 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.532 ' N ' ' HE2' ' B' ' 371' ' ' LYS . 0.3 OUTLIER -37.66 -36.88 0.19 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.052 179.813 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . 0.702 ' ND2' HD12 ' B' ' 366' ' ' LEU . 7.7 m-80 -63.79 -43.29 96.79 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 0.799 ' HA ' HD13 ' B' ' 432' ' ' LEU . . . -60.55 -68.68 0.28 Allowed 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.532 ' HE2' ' N ' ' B' ' 368' ' ' MET . 0.1 OUTLIER -34.03 -49.39 0.35 Allowed 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.711 -179.844 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.546 ' O ' ' CB ' ' B' ' 376' ' ' SER . 5.0 tmm_? -60.65 -36.59 79.05 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.922 179.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.595 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -63.9 -49.81 71.21 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.88 179.581 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 0.624 HD23 ' N ' ' B' ' 374' ' ' LEU . 0.4 OUTLIER -58.51 -67.04 0.4 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.607 -178.843 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . 0.497 ' O ' ' HA3' ' B' ' 379' ' ' GLY . 3.3 m-85 -71.51 -50.79 27.97 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -177.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.546 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.5 OUTLIER -66.57 -53.97 28.73 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -178.789 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.541 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.1 OUTLIER -76.06 -38.27 57.3 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 -178.466 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.541 HD13 ' O ' ' B' ' 377' ' ' LEU . 4.8 mm -131.79 38.84 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.064 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.497 ' HA3' ' O ' ' B' ' 375' ' ' TYR . . . -121.99 63.15 0.52 Allowed Glycine 0 N--CA 1.453 -0.181 0 C-N-CA 120.372 -0.918 . . . . 0.0 112.552 179.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.636 ' O ' ' HB3' ' B' ' 381' ' ' ALA . 3.0 p90 -86.05 -3.23 58.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.527 0.204 . . . . 0.0 111.1 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . 0.636 ' HB3' ' O ' ' B' ' 380' ' ' TYR . . . 99.05 -171.05 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.592 -179.277 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . 0.443 ' C ' ' O ' ' B' ' 381' ' ' ALA . 10.4 m 26.2 35.68 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.542 -0.754 . . . . 0.0 112.038 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.589 ' N ' ' O ' ' B' ' 381' ' ' ALA . 0.8 OUTLIER -103.21 -24.88 13.53 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.836 0.35 . . . . 0.0 110.914 -179.398 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . 0.497 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 3.5 tpt85 61.05 51.74 4.34 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.227 179.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.572 ' HA ' HG12 ' B' ' 406' ' ' VAL . 7.8 tt -94.87 123.99 38.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.067 179.229 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . 0.496 ' O ' ' O ' ' B' ' 405' ' ' ARG . 2.2 p-80 -148.34 151.67 35.75 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.855 0.836 . . . . 0.0 113.179 -178.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.523 ' OH ' HD13 ' B' ' 374' ' ' LEU . 8.1 m-85 -105.45 156.66 17.99 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.724 -1.125 . . . . 0.0 110.11 178.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . 1.031 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -133.98 124.52 46.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 121.236 0.541 . . . . 0.0 110.847 179.588 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -85.21 119.93 26.14 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.439 -179.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 0.974 HG23 HG23 ' B' ' 401' ' ' ILE . 32.8 m -130.86 151.91 36.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.365 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.6 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.1 OUTLIER 85.2 16.02 0.16 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.335 179.638 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.53 ' C ' ' O ' ' B' ' 391' ' ' LYS . 22.3 mmtt -3.51 121.63 0.0 OUTLIER Pre-proline 0 N--CA 1.472 0.674 0 O-C-N 123.987 0.805 . . . . 0.0 112.348 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.482 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 25.5 Cg_exo -56.61 162.62 8.07 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.412 2.075 . . . . 0.0 112.788 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . 0.495 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 1.1 p -156.5 168.57 26.95 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.399 -0.818 . . . . 0.0 111.73 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -81.24 8.03 9.93 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.103 179.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . 0.443 ' O ' ' HB2' ' B' ' 397' ' ' ASP . 24.2 m -132.11 14.83 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.448 0.642 . . . . 0.0 109.578 178.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . 0.443 ' HB2' ' O ' ' B' ' 396' ' ' VAL . 0.1 OUTLIER 166.03 58.33 0.0 OUTLIER Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.765 -179.644 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.495 ' HA ' ' H ' ' B' ' 394' ' ' THR . 5.2 Cg_exo -39.86 -52.69 2.63 Favored 'Trans proline' 0 N--CA 1.461 -0.388 0 C-N-CA 123.525 2.817 . . . . 0.0 112.281 -179.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.54 ' HB3' ' HA ' ' B' ' 418' ' ' ARG . 0.8 OUTLIER -25.11 132.14 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.323 -0.853 . . . . 0.0 112.113 -178.84 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . 0.479 ' HB2' ' HG3' ' B' ' 393' ' ' PRO . 18.4 t -135.86 144.52 45.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.951 179.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 0.974 HG23 HG23 ' B' ' 390' ' ' VAL . 0.2 OUTLIER -112.27 139.46 36.85 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.591 0 CA-C-O 120.949 0.404 . . . . 0.0 110.662 -179.861 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.692 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.7 OUTLIER -100.01 161.23 3.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.773 -179.669 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 1.031 ' CB ' HG23 ' B' ' 388' ' ' VAL . 2.8 mm-40 -128.13 109.05 11.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.528 178.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.716 ' SG ' ' HB2' ' B' ' 431' ' ' ALA . 10.6 t -97.62 108.24 20.92 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.583 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.571 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -153.59 173.46 15.73 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 121.141 0.496 . . . . 0.0 111.532 -179.321 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.572 HG12 ' HA ' ' B' ' 385' ' ' LEU . 1.4 m -150.85 -175.84 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.989 -179.282 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . 0.418 ' N ' HG23 ' B' ' 406' ' ' VAL . . . 55.74 -103.85 0.27 Allowed Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.379 179.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -157.87 19.33 0.26 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.944 0.402 . . . . 0.0 110.883 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 173.05 25.52 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.878 -0.677 . . . . 0.0 113.145 179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.571 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 24.4 m -113.17 110.3 20.19 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 117.102 0.451 . . . . 0.0 110.607 179.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . 0.456 ' HA ' ' HB3' ' B' ' 405' ' ' ARG . 10.5 t -102.33 95.48 3.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-O 120.678 0.275 . . . . 0.0 111.346 -179.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.624 HD13 ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -56.28 -22.34 29.54 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.933 0.397 . . . . 0.0 110.009 179.466 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 164.68 -167.38 38.45 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.485 -0.864 . . . . 0.0 112.729 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.678 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.1 OUTLIER -153.53 148.14 26.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.887 0.375 . . . . 0.0 110.872 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.524 ' HA2' ' HG2' ' B' ' 426' ' ' ARG . . . -130.91 151.24 19.55 Favored Glycine 0 C--O 1.225 -0.449 0 C-N-CA 120.187 -1.006 . . . . 0.0 113.149 -179.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . 0.78 ' HB ' HD12 ' B' ' 401' ' ' ILE . 1.9 p -152.11 126.13 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.134 0.492 . . . . 0.0 111.554 179.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.932 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -138.24 170.1 23.98 Favored Glycine 0 N--CA 1.449 -0.464 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.834 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.54 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 0.6 OUTLIER -83.88 -47.42 11.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.977 0.388 . . . . 0.0 111.572 -179.69 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.936 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.2 OUTLIER -80.17 -25.77 39.63 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.53 -179.579 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.936 HG23 ' O ' ' B' ' 419' ' ' ASN . 1.5 pp 112.23 -43.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 124.703 1.201 . . . . 0.0 110.138 -179.138 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.559 ' N ' HD12 ' B' ' 420' ' ' ILE . 0.3 OUTLIER -45.8 -59.15 2.96 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 179.382 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.932 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -47.63 -16.75 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.473 0 CA-C-N 114.992 -1.003 . . . . 0.0 109.862 177.685 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.741 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -87.2 -49.89 6.98 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 177.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . . . . . . . . . . . -58.12 -44.36 94.81 Favored Glycine 0 C--N 1.338 0.68 0 C-N-CA 119.776 -1.202 . . . . 0.0 110.503 178.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.827 HG23 ' HB3' ' B' ' 367' ' ' ASP . 1.1 mm -68.46 -65.03 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.277 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.616 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 12.9 tpt180 -40.17 -28.51 0.06 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.026 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.506 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -75.19 -52.96 9.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.714 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 0.713 ' HB1' ' CB ' ' B' ' 370' ' ' ALA . . . -50.32 -50.5 50.68 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-O 121.411 0.624 . . . . 0.0 109.439 178.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 1.005 ' HA ' HD22 ' B' ' 432' ' ' LEU . 57.8 mt-10 -60.19 -60.21 4.18 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 177.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.524 ' C ' ' O ' ' B' ' 429' ' ' GLU . 3.8 m120 -24.41 -45.73 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.308 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.716 ' HB2' ' SG ' ' B' ' 404' ' ' CYS . . . -70.63 -54.46 11.89 Favored 'General case' 0 CA--C 1.52 -0.198 0 CA-C-O 121.129 0.49 . . . . 0.0 110.103 178.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 1.005 HD22 ' HA ' ' B' ' 429' ' ' GLU . 0.0 OUTLIER -73.7 3.12 6.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.198 178.956 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . 0.573 ' N ' HD23 ' B' ' 432' ' ' LEU . 0.8 OUTLIER -87.21 -8.48 56.8 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.851 -179.104 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.483 ' O ' ' HG ' ' B' ' 438' ' ' LEU . 48.0 t0 -115.84 93.05 4.09 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.784 0.326 . . . . 0.0 110.905 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.609 ' HG2' ' N ' ' B' ' 436' ' ' LYS . 0.6 OUTLIER -61.03 -42.2 98.02 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.178 -0.464 . . . . 0.0 109.875 179.54 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.609 ' N ' ' HG2' ' B' ' 435' ' ' LYS . 25.4 mttt -54.61 -48.28 72.39 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.387 179.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.492 ' CE ' ' HG ' ' B' ' 412' ' ' LEU . 13.1 tmm? -71.46 -50.14 34.55 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.285 179.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.985 HD11 ' HA ' ' B' ' 432' ' ' LEU . 74.9 mt -50.81 -60.87 2.61 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.43 0.633 . . . . 0.0 110.123 179.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . 0.412 ' O ' ' N ' ' B' ' 442' ' ' ALA . 11.3 t70 -59.09 -41.5 88.22 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.321 178.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.529 ' CD1' ' C ' ' B' ' 440' ' ' PHE . 0.0 OUTLIER -44.04 -46.56 8.5 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 179.49 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.513 ' O ' ' CG ' ' B' ' 444' ' ' GLN . 55.9 m-85 -66.96 -39.78 87.32 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.22 179.042 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . 0.412 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -46.98 -60.16 2.63 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 177.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -47.32 -40.63 17.51 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 178.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.668 ' HG3' ' N ' ' B' ' 445' ' ' ARG . 0.0 OUTLIER -58.23 -52.15 66.78 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.678 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.668 ' N ' ' HG3' ' B' ' 444' ' ' GLN . 0.4 OUTLIER -45.74 -42.18 11.58 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.744 179.813 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -71.74 -38.29 70.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.09 0.472 . . . . 0.0 110.209 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . 0.51 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -73.95 -77.66 0.11 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.047 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.524 HD11 ' O ' ' B' ' 445' ' ' ARG . 0.5 OUTLIER 20.01 92.75 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.278 0 O-C-N 123.721 0.638 . . . . 0.0 111.897 -179.808 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_exo -41.65 161.82 0.03 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.924 2.416 . . . . 0.0 112.591 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.33 -4.42 45.01 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.854 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.72 120.14 32.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.678 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 51.3 102.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.027 -179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.972 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.588 " O2'" " O5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.513 0 O4'-C1'-N19 111.418 3.218 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.588 " O5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.112 0 O4'-C1'-N19 111.08 2.88 . 0.141 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.607 HO2' " C5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.766 0 C3'-C2'-C1' 104.97 3.855 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.607 " C5'" HO2' ' A' ' 3' ' ' ' G' . . . . . . . . 0 P--O5' 1.614 2.102 0 O4'-C1'-N19 111.07 2.87 . 0.048 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.529 ' C6 ' " H2'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.442 2.297 0 O4'-C1'-N19 111.383 3.183 . 0.141 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.636 HO2' " C5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.409 0 O4'-C1'-N19 111.285 3.085 . 0.193 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.636 " C5'" HO2' ' A' ' 6' ' ' ' A' . . . . . . . . 0 P--O5' 1.614 2.145 0 O4'-C1'-N19 111.249 3.049 . 0.078 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.656 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.207 0 O4'-C1'-N19 111.0 2.8 . 0.147 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.753 " O2'" " H5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.379 0 O4'-C1'-N19 110.983 2.783 . 0.166 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.753 " H5'" " O2'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.697 0 C3'-C2'-C1' 104.652 3.502 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.637 ' C2 ' ' C2 ' ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.64 0 C5'-C4'-C3' 111.089 -2.941 . 0.011 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.833 " O5'" ' H6 ' ' A' ' 12' ' ' ' U' . . . . . . . . 0 P--O5' 1.611 1.791 0 C5'-C4'-C3' 110.913 -3.058 . 0.014 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.751 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.651 0 C3'-C2'-C1' 104.817 3.685 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.741 ' C5 ' ' C8 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.447 0 O4'-C1'-N19 110.875 2.675 . 0.029 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.741 ' C8 ' ' C5 ' ' A' ' 14' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.455 0 C5'-C4'-C3' 111.014 -2.991 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.598 ' OP2' ' N2 ' ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.432 -1.764 0 O4'-C1'-N19 111.417 3.217 . 0.024 1t . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.451 ' P ' HO2' ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.423 -2.485 0 C3'-C2'-C1' 104.584 3.426 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.67 ' N1 ' " O2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.804 0 C5'-C4'-C3' 110.806 -3.129 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.665 ' C2 ' ' NH2' ' B' ' 372' ' ' ARG . . . . . . . . 0 O4'--C4' 1.427 -2.132 0 O4'-C1'-N19 111.492 3.292 . 0.308 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.955 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.435 1.737 0 C5'-C4'-C3' 111.006 -2.996 . 0.083 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.955 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.556 0 C3'-C2'-C1' 104.557 3.397 . 0.051 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.775 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 2.025 0 O4'-C1'-N19 111.109 2.909 . 0.158 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.797 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.29 0 O4'-C1'-N19 111.318 3.118 . 0.074 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.797 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.421 -2.681 0 C3'-C2'-C1' 105.01 3.9 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . 0.631 ' N7 ' ' C2 ' ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.442 2.339 0 O4'-C1'-N19 111.206 3.006 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.578 HO2' " C5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.448 0 O4'-C1'-N19 111.214 3.014 . 0.214 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.752 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.075 0 O4'-C1'-N19 110.976 2.776 . 0.158 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.752 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.37 0 C3'-C2'-C1' 104.874 3.749 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.903 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.442 2.296 0 O4'-C1'-N19 111.116 2.916 . 0.052 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 0.903 " H5'" " O2'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.332 0 O4'-C1'-N19 111.61 3.41 . 0.266 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 0.76 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.549 0 O4'-C1'-N19 111.383 3.183 . 0.174 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . 0.568 " O4'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.294 0 O4'-C1'-N19 111.131 2.931 . 0.15 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . 0.459 ' O ' ' HB2' ' B' ' 365' ' ' SER . . . . . . . . 0 N--CA 1.488 2.162 0 N-CA-C 112.43 -0.268 . . . . 0.0 112.43 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . 0.459 ' HB2' ' O ' ' B' ' 364' ' ' GLY . 0.1 OUTLIER 80.1 50.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.774 0.321 . . . . 0.0 110.989 179.787 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . . . . . . . . . 1.2 mp -128.09 124.04 36.02 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.056 0.455 . . . . 0.0 111.508 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.506 ' HB3' ' CG1' ' B' ' 425' ' ' ILE . 0.3 OUTLIER -54.75 -71.23 0.08 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.213 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.447 ' C ' ' O ' ' B' ' 367' ' ' ASP . 0.0 OUTLIER -32.39 -49.36 0.2 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.931 179.805 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 57.2 m-20 -62.14 -47.42 84.64 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.685 -179.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 1.084 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -61.64 -71.14 0.16 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.656 0.265 . . . . 0.0 110.303 179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.517 ' HG2' " O2'" ' A' ' 20' ' ' ' A' . 0.2 OUTLIER -33.09 -46.46 0.16 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.038 179.849 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.666 ' CZ ' ' C2 ' ' A' ' 18' ' ' ' A' . 0.0 OUTLIER -66.69 -38.31 86.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.648 -179.484 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.848 HE22 HD22 ' B' ' 438' ' ' LEU . 3.8 tm0? -61.63 -59.02 5.84 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.352 0.596 . . . . 0.0 110.639 179.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 0.658 HD11 ' HB3' ' B' ' 431' ' ' ALA . 2.3 mm? -58.18 -65.34 0.66 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.9 -1.046 . . . . 0.0 112.749 -178.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . 0.541 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 63.2 m-85 -73.64 -42.37 61.5 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -177.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.554 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -78.36 -52.9 7.9 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 120.503 -0.479 . . . . 0.0 111.671 -179.267 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.607 ' O ' HD13 ' B' ' 378' ' ' ILE . 0.6 OUTLIER -76.32 -31.28 58.08 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -178.376 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.607 HD13 ' O ' ' B' ' 377' ' ' LEU . 4.3 mm -141.56 39.12 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 C-N-CA 120.737 -0.385 . . . . 0.0 111.81 -179.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.541 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -115.34 94.24 0.65 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.351 -0.928 . . . . 0.0 113.338 -179.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.773 ' CE1' HD12 ' B' ' 383' ' ' LEU . 0.4 OUTLIER -145.77 -178.11 5.94 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.278 -0.268 . . . . 0.0 110.278 179.448 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -91.76 75.92 5.68 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.9 0.381 . . . . 0.0 111.373 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . 0.588 ' HB2' ' CE2' ' B' ' 380' ' ' TYR . 0.7 OUTLIER -170.31 -68.68 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.864 179.686 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.852 HD22 ' N ' ' B' ' 384' ' ' ARG . 0.0 OUTLIER -51.12 -41.4 60.03 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.183 -0.302 . . . . 0.0 110.183 179.612 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . 0.852 ' N ' HD22 ' B' ' 383' ' ' LEU . 2.1 tpt85 72.78 89.41 0.09 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 178.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.75 ' HA ' HG12 ' B' ' 406' ' ' VAL . 0.1 OUTLIER -63.89 147.08 52.77 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.647 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . 0.538 ' CB ' ' O ' ' B' ' 405' ' ' ARG . 0.1 OUTLIER -147.94 70.18 1.14 Allowed 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -178.943 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.583 ' CE2' ' HB1' ' B' ' 427' ' ' ALA . 4.0 m-85 -91.59 113.65 25.97 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.383 177.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . 0.465 HG23 ' HB3' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -109.28 133.11 55.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.735 0.302 . . . . 0.0 110.706 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 5.3 m -87.76 125.35 34.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.0 0.429 . . . . 0.0 110.536 179.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 0.926 HG23 HG23 ' B' ' 401' ' ' ILE . 27.1 m -131.38 159.68 42.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.582 -179.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.828 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 88.4 23.48 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.45 179.41 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.519 ' O ' ' O ' ' B' ' 391' ' ' LYS . 9.6 mmtt 1.78 118.28 0.0 OUTLIER Pre-proline 0 N--CA 1.472 0.673 0 O-C-N 124.249 0.968 . . . . 0.0 112.476 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.467 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 22.8 Cg_exo -61.01 162.59 18.78 Favored 'Trans proline' 0 N--CA 1.463 -0.272 0 C-N-CA 122.677 2.251 . . . . 0.0 113.153 -179.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . 0.439 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 2.9 p -127.82 170.46 12.76 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.768 -1.106 . . . . 0.0 111.194 -179.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . 0.478 ' O ' " O2'" ' A' ' 30' ' ' ' C' . . . -97.09 19.64 12.59 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.227 0.537 . . . . 0.0 110.905 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 31.5 m -137.5 8.24 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.946 178.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . 0.495 ' O ' ' N ' ' B' ' 399' ' ' ASN . 1.2 m-20 164.91 62.47 0.0 OUTLIER Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 114.82 -1.082 . . . . 0.0 108.929 -179.289 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.546 ' HB2' ' O ' ' B' ' 418' ' ' ARG . 47.2 Cg_exo -34.04 -25.78 0.03 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 123.882 3.055 . . . . 0.0 113.943 -179.079 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.535 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 23.0 m120 -16.19 122.04 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 179.645 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -143.61 151.72 40.5 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.014 0.435 . . . . 0.0 111.303 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 0.926 HG23 HG23 ' B' ' 390' ' ' VAL . 0.7 OUTLIER -116.8 144.95 23.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.188 -179.591 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.664 ' O ' HG22 ' B' ' 414' ' ' THR . 0.2 OUTLIER -110.25 150.22 12.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.294 -179.714 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 0.475 ' O ' ' HA ' ' B' ' 387' ' ' TYR . 0.1 OUTLIER -109.43 103.7 12.65 Favored 'General case' 0 CA--C 1.521 -0.156 0 CA-C-O 120.922 0.392 . . . . 0.0 109.965 178.967 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.47 ' SG ' ' O ' ' B' ' 413' ' ' GLY . 0.0 OUTLIER -81.4 91.2 6.25 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 179.296 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.563 ' CG ' ' O ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -133.97 152.27 51.79 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.202 -179.046 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.75 HG12 ' HA ' ' B' ' 385' ' ' LEU . 0.9 OUTLIER -126.41 -174.5 1.08 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.507 0 CA-C-O 120.852 0.358 . . . . 0.0 111.202 -179.735 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 57.33 -94.4 0.04 OUTLIER Glycine 0 C--N 1.335 0.495 0 C-N-CA 120.791 -0.719 . . . . 0.0 111.872 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -164.45 26.51 0.07 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.019 0.438 . . . . 0.0 109.843 179.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 168.35 -16.48 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.526 -0.845 . . . . 0.0 113.146 -179.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.563 ' O ' ' CG ' ' B' ' 405' ' ' ARG . 56.5 m -70.17 133.6 47.26 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 179.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . 0.602 HG12 ' N ' ' B' ' 412' ' ' LEU . 39.2 t -85.04 -115.15 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 C-N-CA 120.22 -0.592 . . . . 0.0 112.012 -178.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.602 ' N ' HG12 ' B' ' 411' ' ' VAL . 0.0 OUTLIER 138.24 -45.85 0.01 OUTLIER 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 -178.357 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . 0.477 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 173.38 -176.45 46.04 Favored Glycine 0 N--CA 1.447 -0.619 0 CA-C-N 114.97 -1.014 . . . . 0.0 112.564 179.442 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.664 HG22 ' O ' ' B' ' 402' ' ' VAL . 0.2 OUTLIER -144.04 155.26 43.92 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.749 -0.226 . . . . 0.0 110.731 -179.719 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.486 ' CA ' ' HG3' ' B' ' 426' ' ' ARG . . . -146.18 140.96 9.19 Favored Glycine 0 C--O 1.226 -0.365 0 C-N-CA 120.063 -1.065 . . . . 0.0 112.853 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . 0.425 ' HB ' HD12 ' B' ' 401' ' ' ILE . 9.4 p -130.94 152.35 37.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.55 0.214 . . . . 0.0 110.474 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.863 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -164.45 155.29 26.6 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.589 -0.815 . . . . 0.0 112.48 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.546 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 1.5 ptm180 -64.2 -44.05 93.15 Favored 'General case' 0 N--CA 1.463 0.19 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -179.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.775 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.6 OUTLIER -102.4 31.58 3.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.584 0.23 . . . . 0.0 110.412 179.304 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.743 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 54.28 -45.39 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 N-CA-C 114.676 1.361 . . . . 0.0 114.676 178.752 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.785 ' HG2' HD13 ' B' ' 425' ' ' ILE . 0.0 OUTLIER -44.41 -57.24 3.66 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.863 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -47.87 -24.27 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.328 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.743 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -79.62 -48.46 13.71 Favored 'General case' 0 N--CA 1.439 -1.017 0 N-CA-C 107.446 -1.316 . . . . 0.0 107.446 177.05 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . 0.66 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -59.17 -50.33 68.9 Favored Glycine 0 N--CA 1.449 -0.477 0 N-CA-C 110.165 -1.174 . . . . 0.0 110.165 178.116 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.785 HD13 ' HG2' ' B' ' 421' ' ' LYS . 1.2 mp -59.47 -66.82 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 177.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.58 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 10.4 tpt180 -38.07 -31.87 0.06 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.091 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.66 ' HB3' ' O ' ' B' ' 424' ' ' GLY . . . -62.92 -62.39 1.75 Allowed 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.509 178.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 1.084 ' CB ' ' HB1' ' B' ' 370' ' ' ALA . . . -53.49 -50.26 65.74 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.6 ' O ' HD22 ' B' ' 432' ' ' LEU . 0.6 OUTLIER -56.03 -18.87 10.63 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.76 179.235 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.516 ' ND2' ' O ' ' B' ' 414' ' ' THR . 0.8 OUTLIER -81.34 -38.72 26.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.57 -0.287 . . . . 0.0 110.808 179.644 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.658 ' HB3' HD11 ' B' ' 374' ' ' LEU . . . -72.91 -33.42 65.98 Favored 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -178.246 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.877 ' C ' HD23 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -81.76 8.84 9.07 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.887 0.375 . . . . 0.0 111.527 -179.443 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . 0.684 ' N ' HD23 ' B' ' 432' ' ' LEU . 1.3 mtm180 -85.6 -3.91 59.01 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.939 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -115.25 79.55 1.3 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.386 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.542 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -48.0 -54.27 13.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.719 0.295 . . . . 0.0 111.071 -179.799 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.542 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 13.7 mtpp -55.2 -40.9 71.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.84 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.472 ' O ' ' HB3' ' B' ' 440' ' ' PHE . 17.5 tmm? -69.48 -52.97 21.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.993 0.425 . . . . 0.0 110.139 179.282 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.848 HD22 HE22 ' B' ' 373' ' ' GLN . 74.3 mt -50.73 -61.9 1.92 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.544 0.688 . . . . 0.0 110.329 179.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -49.43 -48.16 47.57 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.922 -1.035 . . . . 0.0 109.543 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.515 ' CD1' ' C ' ' B' ' 440' ' ' PHE . 0.1 OUTLIER -43.75 -42.67 5.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.484 179.743 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.622 ' CE2' ' HB2' ' B' ' 383' ' ' LEU . 36.8 m-85 -69.88 -36.74 75.69 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.094 179.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -51.34 -60.73 2.8 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 178.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . 0.424 ' C ' ' CD ' ' B' ' 443' ' ' LYS . 0.0 OUTLIER -48.08 -43.21 30.42 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 178.064 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.542 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -55.38 -55.83 27.07 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.262 178.954 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.596 ' HD2' ' CD2' ' B' ' 380' ' ' TYR . 0.2 OUTLIER -44.39 -36.98 3.1 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.347 179.582 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -81.43 -36.37 29.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.642 179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . 0.481 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -64.68 -67.56 0.43 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.238 -179.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.508 HG12 ' O ' ' B' ' 445' ' ' ARG . 0.1 OUTLIER 28.34 89.01 0.08 OUTLIER Pre-proline 0 N--CA 1.464 0.245 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.135 179.556 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . 0.42 ' HD2' ' HA ' ' B' ' 448' ' ' ILE . 2.6 Cg_endo -49.82 -19.76 4.04 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 122.844 2.363 . . . . 0.0 112.592 -179.246 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.09 -66.81 0.46 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.519 -179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -122.07 -171.02 2.17 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.94 0.4 . . . . 0.0 111.562 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 45.69 33.04 1.34 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.111 -179.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 5.2 p . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.233 -0.889 . . . . 0.0 111.012 179.808 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.424 -2.376 0 O4'-C1'-N19 111.3 3.1 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.442 2.371 0 O4'-C1'-N19 111.278 3.078 . 0.375 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.691 HO2' " C5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.692 0 C3'-C2'-C1' 105.078 3.976 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.691 " C5'" HO2' ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.133 0 O4'-C1'-N19 111.393 3.193 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.519 " O4'" ' HB3' ' B' ' 398' ' ' PRO . . . . . . . . 0 O4'--C1' 1.439 2.119 0 O4'-C1'-N19 111.104 2.904 . 0.062 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.515 " H2'" ' C6 ' ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.345 0 O4'-C1'-N19 111.107 2.907 . 0.127 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.8 ' H6 ' " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.437 1.922 0 O4'-C1'-N19 111.159 2.959 . 0.278 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.666 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.185 0 O4'-C1'-N19 111.222 3.022 . 0.334 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.666 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.439 0 O4'-C1'-N19 111.169 2.969 . 0.094 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.79 ' H6 ' " O5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.437 1.897 0 C5'-C4'-C3' 110.968 -3.021 . 0.032 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.636 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.39 0 C3'-C2'-C1' 104.154 2.949 . 0.02 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.678 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 P--O5' 1.612 1.903 0 O4'-C1'-N19 111.127 2.927 . 0.012 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.678 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.698 0 C3'-C2'-C1' 104.653 3.503 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.643 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.719 0 C3'-C2'-C1' 104.368 3.187 . 0.015 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.661 " C2'" ' H61' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.431 -1.827 0 C5'-C4'-C3' 111.091 -2.939 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.659 ' C8 ' ' C6 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.431 -1.863 0 C5'-C4'-C3' 110.623 -3.251 OUTLIER-EPSILON 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.595 ' OP2' " H1'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 P--O5' 1.613 1.99 0 C5'-C4'-C3' 110.859 -3.094 OUTLIER-DELTA 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.688 " O3'" ' H8 ' ' A' ' 19' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.281 0 O4'-C1'-N19 111.475 3.275 OUTLIER-EPSILON 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.688 ' H8 ' " O3'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.537 0 P-O3'-C3' 123.445 3.121 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.679 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.677 0 C5'-C4'-C3' 111.078 -2.948 . 0.202 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.592 " O2'" " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.54 0 C3'-C2'-C1' 104.414 3.238 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.847 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.974 0 C5'-C4'-C3' 111.196 -2.87 . 0.026 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.664 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.438 0 O4'-C1'-N19 111.73 3.53 . 0.029 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.686 ' H6 ' " O5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 P--O5' 1.616 2.343 0 O4'-C1'-N19 110.784 2.584 . 0.087 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . 0.503 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.254 0 O4'-C1'-N19 111.159 2.959 . 0.38 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.575 " O2'" " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.481 0 O4'-C1'-N19 111.179 2.979 . 0.155 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.676 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.024 0 C5'-C4'-C3' 111.185 -2.876 . 0.082 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.676 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.411 0 C3'-C2'-C1' 104.324 3.138 . 0.046 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.594 " O5'" " O2'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.443 2.405 0 O4'-C1'-N19 111.27 3.07 . 0.163 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 0.98 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.259 0 O4'-C1'-N19 111.311 3.111 . 0.044 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 0.98 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.413 0 O4'-C1'-N19 111.306 3.106 . 0.14 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . 0.603 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.57 0 C5'-C4'-C3' 111.058 -2.961 . 0.084 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.183 0 N-CA-C 112.556 -0.218 . . . . 0.0 112.556 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -160.68 54.63 0.31 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.755 0.312 . . . . 0.0 110.945 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . 0.526 ' O ' ' HB2' ' B' ' 369' ' ' ASN . 3.7 tp -75.8 0.56 17.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.54 -179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.546 ' O ' ' N ' ' B' ' 370' ' ' ALA . 0.1 OUTLIER -36.7 -77.11 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 178.917 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.548 ' CE ' ' N ' ' B' ' 369' ' ' ASN . 0.0 OUTLIER -36.05 -41.28 0.24 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.988 178.994 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . 0.548 ' N ' ' CE ' ' B' ' 368' ' ' MET . 1.7 m-80 -61.8 -44.44 96.85 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.409 179.181 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 0.756 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -56.89 -68.46 0.22 Allowed 'General case' 0 N--CA 1.453 -0.321 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.632 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.5 ' CE ' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -34.56 -47.93 0.34 Allowed 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.029 0.442 . . . . 0.0 110.35 -179.919 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.591 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.0 OUTLIER -56.57 -39.78 74.07 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.592 -0.731 . . . . 0.0 111.008 179.654 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.924 ' OE1' HD23 ' B' ' 377' ' ' LEU . 0.8 OUTLIER -63.62 -60.29 3.51 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.581 0.705 . . . . 0.0 110.751 179.31 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 0.936 HD11 ' HB2' ' B' ' 428' ' ' ALA . 0.2 OUTLIER -49.19 -72.47 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.114 -0.948 . . . . 0.0 113.428 -178.424 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . 0.49 ' HB2' " C5'" ' A' ' 20' ' ' ' A' . 3.8 m-85 -89.01 -2.99 58.84 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -176.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.591 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.3 OUTLIER -119.04 5.73 11.32 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 119.915 -0.714 . . . . 0.0 111.415 179.811 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.924 HD23 ' OE1' ' B' ' 373' ' ' GLN . 9.9 tp -144.11 -32.91 0.42 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.493 179.215 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.527 ' CG1' ' OE1' ' B' ' 373' ' ' GLN . 3.8 mm -134.58 37.15 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 120.836 0.35 . . . . 0.0 111.378 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . . . . . . . . . . . -120.75 93.02 0.52 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.632 -0.794 . . . . 0.0 112.623 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.616 ' CZ ' ' HG ' ' B' ' 383' ' ' LEU . 0.1 OUTLIER -126.93 -98.58 0.39 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.519 0.199 . . . . 0.0 110.985 179.633 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -155.58 -41.42 0.08 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.737 0.303 . . . . 0.0 111.426 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . 0.431 ' OG ' HG22 ' B' ' 448' ' ' ILE . 0.2 OUTLIER -56.26 -51.1 69.37 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.912 0.387 . . . . 0.0 110.645 -180.0 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.871 HD22 ' O ' ' B' ' 383' ' ' LEU . 0.0 OUTLIER -92.13 37.43 0.98 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.873 179.843 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . 0.495 ' O ' ' CG ' ' B' ' 384' ' ' ARG . 2.0 ptm180 -26.21 97.7 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.921 -179.632 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.725 HD22 ' HE1' ' B' ' 387' ' ' TYR . 0.3 OUTLIER -59.89 163.04 4.88 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.955 179.374 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . 0.488 ' CB ' ' O ' ' B' ' 405' ' ' ARG . 0.0 OUTLIER -160.27 83.71 0.71 Allowed 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -179.188 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.725 ' HE1' HD22 ' B' ' 385' ' ' LEU . 60.4 m-85 -87.77 114.91 24.83 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 177.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . 0.49 HG23 ' HB3' ' B' ' 403' ' ' GLU . 0.1 OUTLIER -123.9 115.48 45.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 C-N-CA 120.494 -0.483 . . . . 0.0 112.302 -179.372 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . 0.574 HG23 ' OG ' ' B' ' 400' ' ' SER . 3.9 m -70.37 128.86 37.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.543 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 0.75 HG23 HG23 ' B' ' 401' ' ' ILE . 19.9 m -132.71 159.89 42.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.6 -179.385 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.54 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 92.68 36.85 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.771 179.743 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.51 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER 0.94 117.82 0.0 OUTLIER Pre-proline 0 N--CA 1.472 0.634 0 O-C-N 124.038 0.836 . . . . 0.0 112.704 179.596 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.519 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 26.4 Cg_exo -60.37 163.76 14.3 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.669 2.246 . . . . 0.0 113.249 -179.688 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . 0.452 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 18.2 p -135.43 172.42 13.03 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.055 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . 0.413 ' CB ' ' O2 ' ' A' ' 29' ' ' ' U' . . . -98.05 18.36 16.24 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-O 121.174 0.512 . . . . 0.0 110.472 179.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 11.4 m -125.47 -0.85 5.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.967 178.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . 0.528 ' O ' ' N ' ' B' ' 399' ' ' ASN . 11.6 m-20 170.61 54.47 0.01 OUTLIER Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 114.625 -1.17 . . . . 0.0 108.599 -179.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.519 ' HB3' " O4'" ' A' ' 5' ' ' ' U' . 76.8 Cg_exo -29.56 -32.36 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 124.089 3.193 . . . . 0.0 113.517 -178.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.55 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 6.5 p30 -25.45 142.06 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.863 -178.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . 0.574 ' OG ' HG23 ' B' ' 389' ' ' THR . 1.0 OUTLIER -140.79 158.07 44.49 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.643 -179.222 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 1.082 HD12 HG23 ' B' ' 416' ' ' VAL . 0.2 OUTLIER -110.48 144.49 18.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.432 -0.803 . . . . 0.0 111.303 -179.399 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.884 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.3 OUTLIER -109.7 146.21 15.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.777 -179.202 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 0.49 ' HB3' HG23 ' B' ' 388' ' ' VAL . 6.0 tt0 -111.79 95.95 5.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.073 179.093 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.496 ' SG ' ' CZ ' ' B' ' 387' ' ' TYR . 4.6 t -75.89 87.1 2.86 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.347 -0.842 . . . . 0.0 108.873 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.574 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -133.17 152.83 51.93 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.109 -179.205 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.85 HG22 ' HB ' ' B' ' 410' ' ' THR . 0.9 OUTLIER -145.94 151.27 14.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.714 -179.103 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 67.79 -103.91 1.06 Allowed Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.736 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -149.68 2.76 0.54 Allowed 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -166.37 22.61 0.12 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 119.896 -1.145 . . . . 0.0 113.18 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.903 HG21 ' OH ' ' B' ' 441' ' ' TYR . 0.2 OUTLIER -116.31 97.61 6.13 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 117.116 0.458 . . . . 0.0 110.926 179.536 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . 0.776 ' O ' HG12 ' B' ' 411' ' ' VAL . 56.1 t -106.36 64.92 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.705 179.18 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.841 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.1 OUTLIER -30.66 -35.33 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 120.676 0.274 . . . . 0.0 110.907 -179.56 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . 0.544 ' N ' ' O ' ' B' ' 411' ' ' VAL . . . 165.97 -157.38 29.82 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 119.721 -1.228 . . . . 0.0 113.494 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.5 ' O ' ' ND2' ' B' ' 430' ' ' ASN . 1.1 t -153.89 174.05 15.12 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.27 -0.465 . . . . 0.0 111.803 -178.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.762 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -158.02 139.76 6.56 Favored Glycine 0 C--O 1.222 -0.641 0 C-N-CA 120.298 -0.953 . . . . 0.0 113.123 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . 1.082 HG23 HD12 ' B' ' 401' ' ' ILE . 41.5 t -126.13 149.92 31.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 179.118 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.96 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -163.0 162.16 34.46 Favored Glycine 0 C--O 1.225 -0.407 0 C-N-CA 120.126 -1.035 . . . . 0.0 112.465 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.487 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 1.6 ptt180 -76.95 -41.87 41.45 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.707 0.254 . . . . 0.0 111.684 -179.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.789 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.2 OUTLIER -101.65 27.59 6.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.034 0.445 . . . . 0.0 109.824 179.009 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.687 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 55.75 -44.76 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.499 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 178.485 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.678 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.2 OUTLIER -43.49 -58.92 2.37 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 179.565 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.96 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -45.82 -26.23 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-N 115.837 -0.62 . . . . 0.0 109.667 178.658 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.884 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -77.51 -47.66 19.0 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 177.224 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . 0.586 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -63.6 -55.67 23.84 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.732 178.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.538 ' CG1' ' HB3' ' B' ' 367' ' ' ASP . 0.9 OUTLIER -58.25 -71.71 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 178.621 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.555 ' HB3' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -44.16 -26.19 0.29 Allowed 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.699 -178.743 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.592 ' O ' ' HB2' ' B' ' 430' ' ' ASN . . . -61.62 -54.48 42.37 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 176.809 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 0.936 ' HB2' HD11 ' B' ' 374' ' ' LEU . . . -53.47 -49.49 67.34 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 107.964 -1.125 . . . . 0.0 107.964 177.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.817 ' HA ' HD22 ' B' ' 432' ' ' LEU . 49.7 mt-10 -53.99 -21.97 9.38 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.365 178.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.592 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 0.7 OUTLIER -75.73 -37.28 59.54 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 178.341 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.462 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -68.49 -48.47 64.36 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.299 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.817 HD22 ' HA ' ' B' ' 429' ' ' GLU . 0.1 OUTLIER -76.91 1.31 17.99 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.117 0.484 . . . . 0.0 111.343 -179.953 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . 0.806 ' N ' HD23 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -71.82 -14.26 61.92 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.883 -179.92 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.523 ' HB2' ' HB3' ' B' ' 437' ' ' MET . 5.6 m-20 -120.76 86.64 2.61 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.927 -178.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.583 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 6.1 ptpp? -52.61 -52.62 54.52 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.983 0.421 . . . . 0.0 110.213 179.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.583 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 5.4 mtpp -50.63 -36.41 35.15 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.546 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.841 ' SD ' HD12 ' B' ' 412' ' ' LEU . 1.1 ttp -80.11 -44.76 19.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.724 179.008 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.804 HD11 ' HA ' ' B' ' 432' ' ' LEU . 87.2 mt -53.08 -63.01 1.28 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.669 0.747 . . . . 0.0 109.545 178.709 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . 0.405 ' O ' ' C ' ' B' ' 440' ' ' PHE . 9.1 t70 -55.57 -44.51 76.93 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.029 -0.987 . . . . 0.0 108.973 178.507 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.463 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.1 OUTLIER -41.6 -42.26 2.41 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 179.187 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.903 ' OH ' HG21 ' B' ' 410' ' ' THR . 46.3 m-85 -68.11 -46.45 70.87 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.232 -0.894 . . . . 0.0 110.675 179.348 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . 0.426 ' C ' ' O ' ' B' ' 441' ' ' TYR . . . -42.82 -60.82 1.45 Allowed 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 178.701 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.67 -44.21 57.63 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.84 178.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.522 ' O ' HG12 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -55.11 -55.38 31.7 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.06 179.278 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.735 ' O ' HD11 ' B' ' 448' ' ' ILE . 0.1 OUTLIER -50.49 -41.56 53.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.559 -179.89 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -65.72 -46.09 80.25 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.092 0.472 . . . . 0.0 110.263 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . 0.479 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -74.2 -76.61 0.13 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.76 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.735 HD11 ' O ' ' B' ' 445' ' ' ARG . 0.5 OUTLIER 23.94 87.44 0.08 OUTLIER Pre-proline 0 N--CA 1.463 0.219 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.904 -179.144 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . 0.422 ' O ' ' O ' ' B' ' 448' ' ' ILE . 54.4 Cg_exo -53.2 -161.91 0.0 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.158 0 C-N-CA 122.789 2.326 . . . . 0.0 112.181 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.59 -71.13 0.08 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.777 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 24.4 p -177.35 52.03 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.591 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -118.74 122.96 43.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.792 -179.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 3.4 p . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.333 -0.842 . . . . 0.0 111.047 -179.926 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.756 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.434 1.684 0 O4'-C1'-N19 111.11 2.91 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.756 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.371 0 O4'-C1'-N19 111.245 3.045 . 0.337 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.598 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.441 0 O4'-C1'-N19 111.131 2.931 . 0.243 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.552 " H2'" ' C6 ' ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.187 0 O4'-C1'-N19 111.449 3.249 . 0.135 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.859 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 P--O5' 1.613 1.998 0 C5'-C4'-C3' 111.149 -2.9 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.782 " O2'" " H5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.415 0 O4'-C1'-N19 111.03 2.83 . 0.075 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.782 " H5'" " O2'" ' A' ' 6' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.437 1.94 0 O4'-C1'-N19 111.493 3.293 . 0.247 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.486 ' C4 ' ' N7 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.443 2.454 0 O4'-C1'-N19 111.089 2.889 . 0.233 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.488 " H2'" ' C6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.504 0 C5'-C4'-C3' 111.175 -2.883 . 0.104 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.757 ' H6 ' " O5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.435 1.722 0 C5'-C4'-C3' 110.896 -3.069 . 0.053 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.66 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.434 0 O4'-C1'-N19 111.472 3.272 . 0.018 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.705 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.439 2.095 0 O4'-C1'-N19 111.254 3.054 . 0.032 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.705 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.412 0 C3'-C2'-C1' 104.609 3.455 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.648 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.402 0 C5'-C4'-C3' 111.018 -2.988 . 0.026 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.771 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.43 -1.897 0 C5'-C4'-C3' 110.879 -3.081 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.771 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.431 -1.874 0 O4'-C1'-N19 111.489 3.289 . 0.18 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.519 " O2'" ' P ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.561 0 C5'-C4'-C3' 110.962 -3.025 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.569 " O2'" ' HB2' ' B' ' 376' ' ' SER . . . . . . . . 0 P--O5' 1.61 1.715 0 O4'-C1'-N19 110.991 2.791 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.447 " H2'" ' C8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.037 0 C5'-C4'-C3' 111.193 -2.871 . 0.225 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.81 " H2'" " O4'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.436 1.822 0 C5'-C4'-C3' 111.105 -2.93 . 0.334 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.81 " O4'" " H2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.423 -2.524 0 C3'-C2'-C1' 104.167 2.963 . 0.037 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.905 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.614 2.05 0 O4'-C1'-N19 110.933 2.733 . 0.049 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.679 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.217 0 O4'-C1'-N19 111.665 3.465 . 0.045 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.764 ' H6 ' " O5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.225 0 O4'-C1'-N19 110.85 2.65 . 0.086 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . 0.448 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.261 0 O4'-C1'-N19 111.138 2.938 . 0.351 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.719 HO2' " C5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.315 0 O4'-C1'-N19 111.301 3.101 . 0.077 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.931 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 P--O5' 1.613 1.999 0 C5'-C4'-C3' 111.35 -2.767 . 0.139 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.931 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.286 0 C3'-C2'-C1' 104.299 3.11 . 0.027 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.93 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.28 0 O4'-C1'-N19 111.217 3.017 . 0.175 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 0.93 " H5'" " O2'" ' A' ' 29' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.297 0 O4'-C1'-N19 111.643 3.443 . 0.067 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 0.874 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.424 -2.386 0 O4'-C1'-N19 111.406 3.206 . 0.155 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . 0.668 " H5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.277 0 O4'-C1'-N19 111.105 2.905 . 0.392 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.178 0 N-CA-C 112.444 -0.263 . . . . 0.0 112.444 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 15.2 m -134.31 41.14 2.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.876 0.369 . . . . 0.0 110.815 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -45.23 119.98 2.27 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.208 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.497 ' OD1' ' N ' ' B' ' 367' ' ' ASP . 0.1 OUTLIER -58.16 -64.96 0.73 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.941 179.363 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.509 ' SD ' " O2'" ' A' ' 15' ' ' ' A' . 1.4 ttp -33.74 -48.21 0.27 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.912 179.75 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 32.2 m-20 -61.8 -45.48 93.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.811 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 0.78 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -59.69 -69.67 0.2 Allowed 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 179.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.471 ' HD2' ' HA ' ' B' ' 368' ' ' MET . 0.0 OUTLIER -32.92 -52.74 0.34 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-O 120.977 0.418 . . . . 0.0 110.699 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.5 ' HG2' ' N3 ' ' A' ' 18' ' ' ' A' . 0.0 OUTLIER -58.4 -37.44 75.31 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.074 -179.966 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.6 ' HA ' ' HB2' ' B' ' 377' ' ' LEU . 0.0 OUTLIER -64.09 -65.91 0.61 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.598 0.713 . . . . 0.0 110.904 179.558 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 0.828 HD12 HD11 ' B' ' 385' ' ' LEU . 4.3 mm? -48.14 -68.23 0.2 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.208 -0.906 . . . . 0.0 112.621 -179.217 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . 0.518 ' CE2' ' OP1' ' A' ' 20' ' ' ' A' . 0.2 OUTLIER -79.4 -42.66 25.01 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 114.664 1.357 . . . . 0.0 114.664 -176.785 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.569 ' HB2' " O2'" ' A' ' 18' ' ' ' A' . 0.0 OUTLIER -91.54 10.46 27.83 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -177.619 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.6 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.3 OUTLIER -140.67 -38.18 0.44 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.66 0.266 . . . . 0.0 111.213 179.264 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.572 ' O ' HD13 ' B' ' 383' ' ' LEU . 5.7 mm -121.73 34.64 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 121.081 0.467 . . . . 0.0 110.966 179.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . . . . . . . . . . . -149.31 69.75 0.33 Allowed Glycine 0 N--CA 1.453 -0.232 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.908 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.6 ' CG ' ' HD3' ' B' ' 445' ' ' ARG . 2.2 p90 -61.98 -59.87 4.46 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 -179.035 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . 0.576 ' HB2' ' O ' ' B' ' 380' ' ' TYR . . . 170.29 -29.64 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.875 0.369 . . . . 0.0 111.59 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . 0.488 ' HG ' ' HE2' ' B' ' 380' ' ' TYR . 0.3 OUTLIER -110.39 40.9 1.86 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.321 179.6 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.581 HD21 ' HB ' ' B' ' 406' ' ' VAL . 6.7 tt -115.35 -40.51 3.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.827 -179.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 65.3 65.97 0.55 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.198 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.828 HD11 HD12 ' B' ' 374' ' ' LEU . 0.7 OUTLIER -48.65 155.84 0.52 Allowed 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.482 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . 0.505 ' HB3' ' HG2' ' B' ' 405' ' ' ARG . 0.9 OUTLIER -153.3 98.17 2.24 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -178.681 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.75 ' HB2' ' HA ' ' B' ' 404' ' ' CYS . 0.1 OUTLIER -139.72 151.54 45.94 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.929 176.553 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -144.51 163.65 13.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.749 -177.079 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 3.4 m -102.78 129.95 49.59 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.077 0.465 . . . . 0.0 110.898 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 0.629 HG23 HG23 ' B' ' 401' ' ' ILE . 5.4 m -134.92 162.42 38.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.01 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.56 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 98.92 28.55 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.206 179.933 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.526 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.1 OUTLIER 0.37 117.52 0.0 OUTLIER Pre-proline 0 N--CA 1.473 0.679 0 O-C-N 124.119 0.887 . . . . 0.0 112.247 179.851 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.496 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 18.7 Cg_exo -62.72 158.35 42.68 Favored 'Trans proline' 0 N--CA 1.463 -0.304 0 C-N-CA 122.477 2.118 . . . . 0.0 113.401 -179.229 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . 0.491 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 15.9 p -137.96 167.53 21.57 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.5 -1.227 . . . . 0.0 111.096 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . 0.553 ' O ' " O2'" ' A' ' 30' ' ' ' C' . . . -92.29 17.19 10.12 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-O 121.262 0.553 . . . . 0.0 110.22 179.165 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . 0.407 ' O ' ' CG ' ' B' ' 397' ' ' ASP . 17.4 m -125.67 -6.52 5.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.166 -0.924 . . . . 0.0 109.944 177.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . 0.465 ' N ' ' CD ' ' B' ' 398' ' ' PRO . 28.9 m-20 179.45 54.46 0.05 OUTLIER Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 114.623 -1.172 . . . . 0.0 108.749 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.496 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 57.6 Cg_exo -31.76 -38.38 0.07 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 123.746 2.964 . . . . 0.0 113.643 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.607 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -28.31 139.91 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.493 0.663 . . . . 0.0 112.652 -177.775 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . 0.426 ' O ' ' HB2' ' B' ' 423' ' ' ALA . 12.0 t -141.09 148.79 40.7 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.964 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 0.629 HG23 HG23 ' B' ' 390' ' ' VAL . 12.1 tt -107.57 156.22 8.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 121.133 0.492 . . . . 0.0 111.875 -179.508 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.734 HG23 ' O ' ' B' ' 415' ' ' GLY . 0.2 OUTLIER -127.99 141.1 47.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.652 -179.381 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 0.573 ' O ' ' HB2' ' B' ' 387' ' ' TYR . 0.7 OUTLIER -100.76 94.1 5.9 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.027 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.75 ' HA ' ' HB2' ' B' ' 387' ' ' TYR . 1.1 p -82.26 99.08 9.1 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.861 0.839 . . . . 0.0 110.391 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.741 ' HB2' HG22 ' B' ' 411' ' ' VAL . 0.2 OUTLIER -132.48 164.63 26.15 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.704 -178.71 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.581 ' HB ' HD21 ' B' ' 383' ' ' LEU . 1.2 m -132.59 128.5 57.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.953 0.406 . . . . 0.0 111.96 -178.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . 0.478 ' O ' ' HB3' ' B' ' 408' ' ' ASP . . . 79.64 8.49 87.68 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.921 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . 0.481 ' C ' ' HD2' ' B' ' 405' ' ' ARG . 9.2 t70 66.88 11.68 8.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.87 0.367 . . . . 0.0 110.632 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -125.97 -37.29 0.51 Allowed Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.492 -0.861 . . . . 0.0 112.99 -179.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.623 HG22 HD13 ' B' ' 412' ' ' LEU . 95.0 m -103.13 136.77 42.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.959 0.409 . . . . 0.0 112.035 -179.097 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . 0.741 HG22 ' HB2' ' B' ' 405' ' ' ARG . 79.1 t -120.15 80.25 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.726 179.382 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.751 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.1 OUTLIER -41.19 -38.66 1.14 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.263 -0.426 . . . . 0.0 109.889 179.75 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . 0.468 ' O ' ' SG ' ' B' ' 404' ' ' CYS . . . 172.34 -169.73 42.82 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.374 -0.917 . . . . 0.0 112.916 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.446 ' C ' ' OD1' ' B' ' 430' ' ' ASN . 2.2 t -145.21 138.09 26.25 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.754 0.312 . . . . 0.0 111.207 -178.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.734 ' O ' HG23 ' B' ' 402' ' ' VAL . . . -117.87 133.43 10.45 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.239 -0.982 . . . . 0.0 113.761 -179.013 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . 0.492 ' HA ' ' HA ' ' B' ' 401' ' ' ILE . 11.7 p -117.38 153.96 19.18 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 178.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.938 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -161.98 157.64 29.46 Favored Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.18 -1.01 . . . . 0.0 111.67 -179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.541 ' HA ' ' CB ' ' B' ' 399' ' ' ASN . 1.9 ptm180 -73.67 -40.29 63.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.918 0.39 . . . . 0.0 111.608 -179.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.826 ' H ' HD11 ' B' ' 422' ' ' ILE . 8.2 t30 -100.91 27.17 6.2 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.65 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.697 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 54.91 -47.76 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 179.82 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.517 ' HE2' " O3'" ' A' ' 22' ' ' ' C' . 0.0 OUTLIER -43.62 -59.02 2.37 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.116 -0.633 . . . . 0.0 109.377 -179.714 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.938 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -44.39 -22.2 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.325 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.844 177.906 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.697 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -80.95 -49.79 10.54 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 177.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . 0.506 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -56.36 -48.65 74.02 Favored Glycine 0 C--N 1.337 0.631 0 C-N-CA 119.586 -1.292 . . . . 0.0 110.3 178.344 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.606 ' N ' HD12 ' B' ' 425' ' ' ILE . 1.2 mp -65.4 -64.75 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 177.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.616 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 14.8 tpt180 -39.08 -31.27 0.07 Allowed 'General case' 0 C--O 1.225 -0.196 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 179.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.607 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -65.25 -52.32 55.23 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 108.412 -0.959 . . . . 0.0 108.412 178.053 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 0.78 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -55.91 -51.83 66.23 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 177.516 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.692 ' HA ' HD22 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -57.93 -31.65 67.02 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.862 179.251 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.593 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 19.0 m120 -57.43 -41.21 80.01 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 178.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.619 ' HB3' HD21 ' B' ' 374' ' ' LEU . . . -69.03 -45.14 71.23 Favored 'General case' 0 CA--C 1.527 0.084 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.686 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.964 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -77.67 -9.84 59.19 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.841 0.353 . . . . 0.0 111.445 -179.382 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . 0.739 ' N ' HD23 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -80.08 16.82 1.12 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.672 -179.504 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.48 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 90.3 m-20 -140.27 79.85 1.73 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.656 0.265 . . . . 0.0 110.337 179.103 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.589 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -46.69 -58.5 3.8 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.801 -179.551 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.589 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 1.6 mmpp? -49.65 -37.14 27.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.89 0.376 . . . . 0.0 110.451 -179.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.751 ' SD ' HD12 ' B' ' 412' ' ' LEU . 0.5 OUTLIER -73.84 -51.46 16.21 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.498 179.284 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.964 HD11 ' HA ' ' B' ' 432' ' ' LEU . 90.0 mt -52.36 -61.7 2.11 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.283 0.563 . . . . 0.0 110.691 179.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . 0.475 ' O ' ' N ' ' B' ' 442' ' ' ALA . 3.5 t70 -48.69 -51.13 30.15 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 178.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.479 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -40.13 -42.65 1.49 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 114.906 -1.043 . . . . 0.0 109.063 179.83 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.55 ' HA ' ' HG2' ' B' ' 444' ' ' GLN . 49.8 m-85 -67.72 -42.02 82.59 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.781 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . 0.475 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -43.04 -59.31 2.07 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 177.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.2 -42.91 41.69 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 177.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.846 ' O ' HG23 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -73.39 3.59 5.78 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.906 179.017 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.6 ' HD3' ' CG ' ' B' ' 380' ' ' TYR . 0.0 OUTLIER -99.23 -45.02 6.03 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.371 179.238 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -79.38 -34.8 41.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.728 179.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . 0.526 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -66.8 -66.79 0.51 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.792 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.846 HG23 ' O ' ' B' ' 444' ' ' GLN . 1.1 pt -8.03 81.99 0.03 OUTLIER Pre-proline 0 N--CA 1.465 0.317 0 O-C-N 123.934 0.771 . . . . 0.0 112.551 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . 0.439 ' O ' ' CB ' ' B' ' 450' ' ' ARG . 77.7 Cg_exo -37.77 -59.95 0.48 Allowed 'Trans proline' 0 N--CA 1.461 -0.44 0 C-N-CA 122.914 2.409 . . . . 0.0 112.453 -179.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . 0.439 ' CB ' ' O ' ' B' ' 449' ' ' PRO . 0.0 OUTLIER 78.2 38.0 0.18 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.728 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 17.9 t 50.98 62.68 2.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.825 -179.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 91.4 mt-10 -99.19 112.83 24.89 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.624 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.006 -179.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.788 " O2'" " H5'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 C2'--O2' 1.433 1.507 0 C5'-C4'-C3' 111.03 -2.98 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.788 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.331 0 O4'-C1'-N19 111.251 3.051 . 0.133 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.537 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.278 0 O4'-C1'-N19 111.134 2.934 . 0.354 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.525 " H2'" ' C6 ' ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.133 0 O4'-C1'-N19 111.208 3.008 . 0.125 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.525 ' C6 ' " H2'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.291 0 O4'-C1'-N19 111.467 3.267 . 0.144 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.642 " O2'" " C5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.479 0 C3'-C2'-C1' 104.241 3.045 . 0.072 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.642 " C5'" " O2'" ' A' ' 6' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.124 0 O4'-C1'-N19 111.324 3.124 . 0.104 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.408 ' C4 ' ' N7 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.443 2.39 0 O4'-C1'-N19 111.144 2.944 . 0.366 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.466 " H2'" ' C6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.399 0 O4'-C1'-N19 111.148 2.948 . 0.099 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.643 ' H6 ' " O5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 1.965 0 O4'-C1'-N19 111.23 3.03 . 0.163 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.641 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.427 0 O4'-C1'-N19 111.275 3.075 . 0.046 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.816 " O2'" " H5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.436 1.858 0 C5'-C4'-C3' 110.994 -3.004 . 0.017 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.816 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.608 0 C3'-C2'-C1' 104.795 3.661 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.717 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.426 -2.263 0 C5'-C4'-C3' 111.143 -2.905 . 0.048 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.907 " O2'" " H5'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.427 -2.139 0 C5'-C4'-C3' 110.836 -3.109 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.907 " H5'" " O2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.612 1.894 0 O4'-C1'-N19 111.361 3.161 . 0.0 OUTLIER . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.918 " H1'" ' OP1' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.433 -1.639 0 C5'-C4'-C3' 110.863 -3.091 OUTLIER-EPSILON 0.0 OUTLIER . 0.0 . . . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.918 ' OP1' " H1'" ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.001 0 C5'-C4'-C3' 111.108 -2.928 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.753 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.429 -1.97 0 O4'-C1'-N19 111.229 3.029 . 0.038 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.834 " O2'" " H5'" ' A' ' 21' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.436 1.828 0 C5'-C4'-C3' 110.998 -3.002 . 0.142 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.834 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.436 0 C5'-C4'-C3' 111.067 -2.955 . 0.033 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.794 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.44 2.16 0 O4'-C1'-N19 111.176 2.976 . 0.128 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.571 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.295 0 O4'-C1'-N19 111.76 3.56 . 0.105 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.787 ' H6 ' " O5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 P--O5' 1.615 2.151 0 C5'-C4'-C3' 111.612 -2.592 . 0.096 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . 0.422 ' O6 ' ' O6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.187 0 O4'-C1'-N19 111.334 3.134 . 0.254 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.572 " O2'" " O5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.42 -2.731 0 C5'-C4'-C3' 111.186 -2.876 . 0.081 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.929 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.44 2.19 0 O4'-C1'-N19 111.108 2.908 . 0.129 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.929 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.262 0 C3'-C2'-C1' 104.253 3.059 . 0.132 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.637 " C5'" " O2'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.274 0 O4'-C1'-N19 111.207 3.007 . 0.214 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 0.617 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.443 2.412 0 O4'-C1'-N19 111.351 3.151 . 0.111 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 0.803 " O2'" " H5'" ' A' ' 32' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.423 -2.5 0 O4'-C1'-N19 111.224 3.024 . 0.636 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . 0.803 " H5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.595 0 C5'-C4'-C3' 111.148 -2.901 . 0.582 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.219 0 N-CA-C 112.638 -0.185 . . . . 0.0 112.638 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 6.9 m -71.26 86.53 0.8 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.814 0.34 . . . . 0.0 110.941 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . 0.466 HD23 ' HB3' ' B' ' 368' ' ' MET . 0.2 OUTLIER -125.31 119.89 29.64 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.081 -179.861 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.457 ' OD2' HG13 ' B' ' 425' ' ' ILE . 3.9 t70 -59.58 -61.56 2.53 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.809 179.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.524 ' O ' ' HB2' ' B' ' 372' ' ' ARG . 8.8 ttp -34.6 -50.47 0.45 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.611 179.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -61.92 -48.01 82.35 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.694 -179.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 0.935 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -64.94 -72.5 0.15 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.743 0.306 . . . . 0.0 110.69 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.565 ' HE3' ' H21' ' A' ' 19' ' ' ' G' . 0.0 OUTLIER -34.86 -42.55 0.16 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.857 179.828 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.556 ' O ' ' CB ' ' B' ' 376' ' ' SER . 1.8 ttp-105 -66.64 -39.23 88.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.235 -179.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.741 ' CG ' HD12 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -62.49 -54.67 36.63 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.209 0.528 . . . . 0.0 110.415 179.54 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 0.545 HD21 ' O ' ' B' ' 428' ' ' ALA . 1.1 mm? -55.93 -68.53 0.2 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.267 -0.878 . . . . 0.0 113.048 -179.102 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . 0.582 ' CE2' ' OP1' ' A' ' 20' ' ' ' A' . 3.5 m-85 -74.91 -45.13 44.72 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -177.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.556 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -70.8 -54.25 12.33 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.319 -0.552 . . . . 0.0 111.386 -179.404 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.6 ' C ' HD13 ' B' ' 378' ' ' ILE . 0.0 OUTLIER -71.02 -43.59 67.61 Favored 'General case' 0 CA--C 1.509 -0.618 0 CA-C-O 121.196 0.522 . . . . 0.0 109.971 -178.856 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.627 HG23 ' HB3' ' B' ' 441' ' ' TYR . 2.4 mm -120.36 -138.5 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.926 0 CA-C-N 115.374 -0.83 . . . . 0.0 108.878 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.522 ' O ' ' O ' ' B' ' 380' ' ' TYR . . . 99.53 -22.37 40.91 Favored Glycine 0 C--N 1.321 -0.3 0 C-N-CA 120.943 -0.646 . . . . 0.0 112.089 -179.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 1.094 ' CB ' HD22 ' B' ' 383' ' ' LEU . 0.1 OUTLIER 34.92 -175.41 0.0 OUTLIER 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 178.867 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -121.16 -28.2 4.76 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 113.092 -1.867 . . . . 0.0 109.985 179.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -143.57 50.49 1.37 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.653 179.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 1.094 HD22 ' CB ' ' B' ' 380' ' ' TYR . 0.8 OUTLIER -116.4 -36.14 4.09 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 120.913 0.387 . . . . 0.0 110.421 178.857 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . 0.72 ' H ' HD23 ' B' ' 383' ' ' LEU . 1.9 tpt85 74.71 78.76 0.11 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.718 179.173 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.678 ' HG ' HG12 ' B' ' 406' ' ' VAL . 9.7 tt -107.25 124.29 49.54 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 178.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . 0.421 ' O ' ' O ' ' B' ' 405' ' ' ARG . 26.4 p-80 -145.22 145.91 31.5 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 -178.185 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.676 ' HE1' HD21 ' B' ' 385' ' ' LEU . 3.9 m-85 -106.05 147.74 28.55 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 114.56 -1.2 . . . . 0.0 111.066 178.319 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . 0.535 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -133.43 128.64 55.29 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.351 179.448 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.2 m -86.83 123.75 32.31 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.963 179.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 0.907 HG23 HG23 ' B' ' 401' ' ' ILE . 29.1 m -130.06 154.84 40.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.363 0.602 . . . . 0.0 112.222 -179.314 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.54 ' O ' ' C ' ' B' ' 392' ' ' LYS . 4.4 tptt 90.7 23.68 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.544 179.508 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.54 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.1 OUTLIER 1.71 108.37 0.01 OUTLIER Pre-proline 0 N--CA 1.468 0.439 0 O-C-N 123.966 0.792 . . . . 0.0 112.44 179.766 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.492 ' HD2' ' HA ' ' B' ' 392' ' ' LYS . 6.0 Cg_exo -45.55 160.41 0.16 Allowed 'Trans proline' 0 N--CA 1.462 -0.33 0 C-N-CA 122.856 2.37 . . . . 0.0 113.514 -179.174 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 31.8 p -127.2 169.76 13.13 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.133 -0.94 . . . . 0.0 110.53 179.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . 0.483 ' O ' " O2'" ' A' ' 30' ' ' ' C' . . . -96.19 20.21 10.65 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 121.24 0.543 . . . . 0.0 110.715 179.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 33.6 m -136.05 6.64 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.005 178.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . 0.455 ' O ' ' N ' ' B' ' 399' ' ' ASN . 0.2 OUTLIER 168.17 58.09 0.0 OUTLIER Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 114.949 -1.023 . . . . 0.0 108.847 -179.38 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.477 ' O ' ' HB3' ' B' ' 393' ' ' PRO . 3.3 Cg_exo -35.64 -27.3 0.05 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 124.062 3.175 . . . . 0.0 113.108 -179.292 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.599 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 1.3 p-10 -29.28 120.43 0.14 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.619 -179.646 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . 0.428 ' OG ' ' HD3' ' B' ' 393' ' ' PRO . 48.9 m -130.71 158.17 40.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.906 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 0.907 HG23 HG23 ' B' ' 390' ' ' VAL . 0.4 OUTLIER -115.14 144.89 21.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.991 -179.796 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.677 HG21 ' C ' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -110.77 157.59 11.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.558 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 0.535 ' CB ' HG23 ' B' ' 388' ' ' VAL . 2.4 mm-40 -123.9 119.4 29.53 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.102 179.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.59 ' HB3' ' CZ ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -102.39 103.23 13.63 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.669 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.54 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.8 OUTLIER -142.68 170.44 15.7 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.125 -179.305 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.678 HG12 ' HG ' ' B' ' 385' ' ' LEU . 1.0 OUTLIER -148.57 177.69 0.88 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.547 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.515 -179.03 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 58.2 -102.84 0.28 Allowed Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 115.153 -0.93 . . . . 0.0 112.577 179.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -158.13 21.16 0.25 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.751 0.31 . . . . 0.0 110.842 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 170.99 31.95 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.667 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.54 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 99.3 m -124.31 111.68 16.1 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 121.05 -0.26 . . . . 0.0 110.983 179.519 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 58.2 t -103.61 107.43 22.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 109.986 -0.375 . . . . 0.0 109.986 178.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.564 ' HB3' ' HA ' ' B' ' 431' ' ' ALA . 0.0 OUTLIER -68.42 -26.11 65.37 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.633 -179.829 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . 0.464 ' O ' ' SG ' ' B' ' 404' ' ' CYS . . . 174.34 -177.22 46.61 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.337 -0.935 . . . . 0.0 112.874 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.443 ' O ' ' ND2' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -146.37 152.68 39.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.787 -0.206 . . . . 0.0 110.79 -179.832 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.437 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -149.53 158.06 27.5 Favored Glycine 0 C--O 1.227 -0.302 0 C-N-CA 119.757 -1.211 . . . . 0.0 113.647 -179.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . 0.418 ' HB ' HD12 ' B' ' 401' ' ' ILE . 1.4 p -141.4 151.41 19.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.528 -0.336 . . . . 0.0 110.779 179.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.817 ' CA ' HD13 ' B' ' 422' ' ' ILE . . . -165.18 142.91 8.05 Favored Glycine 0 C--O 1.228 -0.265 0 C-N-CA 120.957 -0.639 . . . . 0.0 111.732 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.52 ' CG ' ' OD1' ' B' ' 419' ' ' ASN . 4.7 ptm180 -60.64 -43.77 97.18 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 -179.059 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.726 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.1 OUTLIER -100.19 34.35 2.37 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 178.893 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.755 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 51.09 -46.39 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 N-CA-C 114.746 1.387 . . . . 0.0 114.746 179.328 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.577 ' N ' HD12 ' B' ' 420' ' ' ILE . 0.0 OUTLIER -43.96 -58.61 2.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 118.784 0.72 . . . . 0.0 109.768 -179.71 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.817 HD13 ' CA ' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -45.06 -19.84 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.418 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 177.261 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.755 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -88.0 -49.26 7.17 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 177.607 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . 0.464 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -58.8 -44.79 95.68 Favored Glycine 0 C--N 1.339 0.708 0 C-N-CA 119.914 -1.136 . . . . 0.0 110.775 178.538 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.457 HG13 ' OD2' ' B' ' 367' ' ' ASP . 2.4 mp -67.25 -64.86 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 178.055 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.601 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -40.41 -26.56 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.816 179.039 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.625 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -73.91 -55.28 6.36 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.529 179.428 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 0.935 ' CB ' ' HB1' ' B' ' 370' ' ' ALA . . . -50.7 -50.57 54.82 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.028 0.442 . . . . 0.0 110.203 179.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.792 ' HA ' HD22 ' B' ' 432' ' ' LEU . 0.6 OUTLIER -58.7 -66.15 0.54 Allowed 'General case' 0 C--O 1.218 -0.553 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 178.094 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.502 ' C ' ' O ' ' B' ' 429' ' ' GLU . 0.3 OUTLIER -24.83 -42.29 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.267 179.512 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.564 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -78.23 -39.12 41.31 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 -179.286 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.832 ' C ' HD23 ' B' ' 432' ' ' LEU . 0.0 OUTLIER -78.75 8.42 5.44 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.146 0.498 . . . . 0.0 111.576 179.812 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . 0.552 ' N ' HD23 ' B' ' 432' ' ' LEU . 0.1 OUTLIER -87.64 -5.25 58.8 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.516 -179.426 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.47 ' OD2' ' HB2' ' B' ' 437' ' ' MET . 54.1 t0 -107.02 90.77 3.4 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.843 0.354 . . . . 0.0 111.283 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.551 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.2 OUTLIER -51.62 -53.3 39.93 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.019 179.94 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.551 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.2 OUTLIER -54.52 -43.66 72.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.973 -179.787 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.545 ' CE ' ' HG ' ' B' ' 412' ' ' LEU . 16.6 tmm? -69.86 -55.4 9.86 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.852 179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.82 HD21 ' HA ' ' B' ' 432' ' ' LEU . 69.7 mt -52.81 -62.79 1.42 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.276 0.56 . . . . 0.0 110.337 179.471 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . 0.431 ' O ' ' N ' ' B' ' 442' ' ' ALA . 14.1 t0 -50.53 -47.27 57.61 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.244 -0.889 . . . . 0.0 108.924 178.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.477 ' HB3' ' O ' ' B' ' 437' ' ' MET . 0.5 OUTLIER -44.12 -41.16 5.44 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.264 179.565 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.627 ' HB3' HG23 ' B' ' 378' ' ' ILE . 43.2 m-85 -74.2 -31.83 62.81 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.436 179.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . 0.431 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -59.32 -61.94 2.25 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.01 -42.58 63.14 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 178.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.472 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -54.48 -56.19 21.27 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.547 -0.752 . . . . 0.0 109.691 178.685 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.665 ' O ' HD11 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -46.43 -38.21 8.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.96 179.649 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -77.29 -40.19 45.33 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.765 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . 0.522 ' O ' ' N ' ' B' ' 449' ' ' PRO . . . -62.27 -59.73 4.59 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.842 -179.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.665 HD11 ' O ' ' B' ' 445' ' ' ARG . 0.5 OUTLIER -30.13 87.95 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.902 -179.881 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . 0.522 ' N ' ' O ' ' B' ' 447' ' ' ALA . 49.9 Cg_exo -60.06 132.64 45.61 Favored 'Trans proline' 0 CA--C 1.52 -0.206 0 C-N-CA 123.118 2.545 . . . . 0.0 112.633 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 1.4 mtt-85 41.28 -151.03 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.723 179.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . 0.457 ' O ' ' HG3' ' B' ' 452' ' ' GLU . 0.0 OUTLIER -152.85 156.58 39.28 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.956 0.408 . . . . 0.0 111.315 179.955 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . 0.457 ' HG3' ' O ' ' B' ' 451' ' ' SER . 4.4 pt-20 36.96 68.27 0.28 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.873 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.131 0 CA-C-O 118.175 -0.916 . . . . 0.0 110.875 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.836 " O5'" ' H8 ' ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.433 1.57 0 O4'-C1'-N19 111.205 3.005 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.833 " H5'" " O2'" ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.269 0 O4'-C1'-N19 111.237 3.037 . 0.149 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.661 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.4 0 O4'-C1'-N19 111.132 2.932 . 0.147 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.642 " C5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.426 -2.244 0 O4'-C1'-N19 111.124 2.924 . 0.112 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.622 " C5'" " O2'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.034 0 C5'-C4'-C3' 111.095 -2.937 . 0.165 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.62 ' OP1' HG21 ' B' ' 420' ' ' ILE . . . . . . . . 0 O4'--C4' 1.423 -2.531 0 O4'-C1'-N19 111.05 2.85 . 0.033 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.544 ' H6 ' " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.439 2.054 0 O4'-C1'-N19 111.502 3.302 . 0.18 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.687 ' N4 ' ' N6 ' ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.441 2.268 0 O4'-C1'-N19 110.965 2.765 . 0.178 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.687 ' N6 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.367 0 O4'-C1'-N19 111.142 2.942 . 0.142 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.679 ' H6 ' " O5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.002 0 C5'-C4'-C3' 110.965 -3.024 . 0.259 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.641 " O2'" " C5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.459 0 C5'-C4'-C3' 111.154 -2.897 . 0.048 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.67 " O2'" " C5'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.43 -1.908 0 C5'-C4'-C3' 110.867 -3.089 . 0.043 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.67 " C5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.425 0 C3'-C2'-C1' 104.414 3.237 . 0.015 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.667 " C5'" " O2'" ' A' ' 13' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.17 0 O4'-C1'-N19 111.114 2.914 . 0.036 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.702 ' N3 ' ' N6 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.432 -1.746 0 C5'-C4'-C3' 111.079 -2.947 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.635 " H1'" ' OP2' ' A' ' 17' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.427 -2.128 0 O4'-C1'-N19 111.47 3.27 OUTLIER-EPSILON 0.0 OUTLIER alpha 0.0 . . . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.635 ' OP2' " H1'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.436 1.812 0 C5'-C4'-C3' 110.998 -3.001 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.702 ' N6 ' ' N3 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.797 0 C5'-C4'-C3' 110.896 -3.069 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.688 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.08 0 C5'-C4'-C3' 110.992 -3.005 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.711 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.795 0 O4'-C1'-N19 111.451 3.251 . 0.062 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.704 " O5'" ' H8 ' ' A' ' 21' ' ' ' A' . . . . . . . . 0 P--O5' 1.614 2.061 0 O4'-C1'-N19 111.613 3.413 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.857 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 P--O5' 1.615 2.215 0 O4'-C1'-N19 111.032 2.832 . 0.017 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.653 " O2'" " C5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.427 -2.14 0 O4'-C1'-N19 111.934 3.734 . 0.077 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.843 ' H6 ' " O5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 P--O5' 1.614 2.099 0 C5'-C4'-C3' 111.383 -2.745 . 0.041 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . 0.446 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.271 0 O4'-C1'-N19 111.158 2.958 . 0.229 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.467 " H2'" ' C6 ' ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.385 0 O4'-C1'-N19 111.232 3.032 . 0.482 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.886 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.055 0 O4'-C1'-N19 111.165 2.965 . 0.145 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.886 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.418 0 C3'-C2'-C1' 104.392 3.213 . 0.021 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.738 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.443 2.452 0 O4'-C1'-N19 111.179 2.979 . 0.208 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 0.83 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.158 0 O4'-C1'-N19 111.531 3.331 . 0.771 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 0.83 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.622 0 O4'-C1'-N19 111.348 3.148 . 0.162 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . 0.487 " C5'" " O2'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.445 0 C5'-C4'-C3' 111.219 -2.854 . 0.352 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . 0.43 ' O ' ' N ' ' B' ' 366' ' ' LEU . . . . . . . . 0 N--CA 1.49 2.265 0 N-CA-C 112.51 -0.236 . . . . 0.0 112.51 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.03 87.05 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.792 0.329 . . . . 0.0 110.862 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . 0.43 ' N ' ' O ' ' B' ' 364' ' ' GLY . 0.3 OUTLIER -138.21 131.3 30.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.1 -179.712 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.535 ' O ' ' N ' ' B' ' 370' ' ' ALA . 4.8 t0 -57.58 -65.61 0.6 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.906 179.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.546 ' HA ' ' CE ' ' B' ' 371' ' ' LYS . 4.5 tmm? -36.86 -46.84 0.65 Allowed 'General case' 0 C--O 1.237 0.405 0 CA-C-O 121.338 0.589 . . . . 0.0 110.256 179.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -61.94 -40.71 96.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.684 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 1.006 ' HB1' ' HB1' ' B' ' 428' ' ' ALA . . . -63.79 -70.36 0.22 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.854 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.548 ' HG2' ' N ' ' B' ' 372' ' ' ARG . 0.0 OUTLIER -35.67 -45.72 0.39 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.842 0.353 . . . . 0.0 110.294 -179.809 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.595 ' HG3' ' C2 ' ' A' ' 18' ' ' ' A' . 5.4 tmm_? -62.32 -39.78 94.17 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.861 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.766 HE22 HD22 ' B' ' 438' ' ' LEU . 4.3 tm0? -62.05 -58.4 7.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.281 0.562 . . . . 0.0 110.75 179.187 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 0.768 HD23 ' N ' ' B' ' 374' ' ' LEU . 0.9 OUTLIER -50.85 -70.39 0.09 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.992 -1.003 . . . . 0.0 113.136 -178.607 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . 0.551 ' HA ' ' HA3' ' B' ' 379' ' ' GLY . 3.0 m-85 -72.65 -49.92 28.58 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -177.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.55 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.4 OUTLIER -65.61 -54.83 22.31 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -178.445 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.909 ' O ' HD13 ' B' ' 378' ' ' ILE . 3.3 tp -75.53 -26.43 58.05 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.909 HD13 ' O ' ' B' ' 377' ' ' LEU . 10.9 mm -125.18 -58.03 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -178.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.551 ' HA3' ' HA ' ' B' ' 375' ' ' TYR . . . -36.61 105.58 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.734 -0.746 . . . . 0.0 113.095 -179.302 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.758 ' CD2' HD12 ' B' ' 383' ' ' LEU . 18.1 p90 -119.58 171.48 8.34 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.758 0.313 . . . . 0.0 110.632 179.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . 0.526 ' O ' ' CB ' ' B' ' 382' ' ' SER . . . -62.9 104.42 0.55 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.087 -179.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' B' ' 381' ' ' ALA . 2.2 t 86.11 45.65 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.388 179.701 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.895 ' O ' HD23 ' B' ' 383' ' ' LEU . 6.3 tt -97.72 -33.62 11.22 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.596 179.584 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . 0.528 ' O ' ' HB ' ' B' ' 406' ' ' VAL . 0.0 OUTLIER 65.53 62.14 0.67 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.914 179.857 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.839 ' HB2' HD22 ' B' ' 383' ' ' LEU . 1.6 tt -108.45 127.97 54.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.661 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . 0.697 ' N ' HD23 ' B' ' 385' ' ' LEU . 35.7 p-80 -154.8 156.79 36.89 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 113.614 0.968 . . . . 0.0 113.614 -179.275 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.621 ' OH ' HD13 ' B' ' 374' ' ' LEU . 3.6 m-85 -112.45 152.43 28.72 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 114.374 -1.285 . . . . 0.0 110.892 178.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . 0.988 HG23 ' HB3' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -135.51 135.14 51.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.712 179.613 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.4 m -95.22 127.13 41.03 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.457 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 0.982 HG23 HG23 ' B' ' 401' ' ' ILE . 31.6 m -131.8 157.85 43.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.198 -179.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.696 ' HB2' HG22 ' B' ' 401' ' ' ILE . 0.0 OUTLIER 87.38 21.73 0.06 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.52 179.737 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.535 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.0 OUTLIER 0.98 116.83 0.0 OUTLIER Pre-proline 0 N--CA 1.472 0.663 0 O-C-N 124.001 0.813 . . . . 0.0 112.476 179.884 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.483 ' HB3' ' O ' ' B' ' 398' ' ' PRO . 20.5 Cg_exo -61.78 162.73 20.84 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 122.472 2.115 . . . . 0.0 112.641 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . 0.504 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 0.7 OUTLIER -155.49 166.11 34.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.159 -179.815 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -82.52 8.92 10.39 Favored 'General case' 0 CA--C 1.527 0.089 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.45 178.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . 0.435 HG22 ' OG1' ' B' ' 394' ' ' THR . 19.1 m -129.61 11.0 2.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.655 0.74 . . . . 0.0 109.208 178.069 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . 0.414 ' H ' ' HD3' ' B' ' 398' ' ' PRO . 0.4 OUTLIER 168.68 60.07 0.0 OUTLIER Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 114.605 -1.18 . . . . 0.0 109.297 -179.908 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.504 ' HA ' ' H ' ' B' ' 394' ' ' THR . 90.3 Cg_exo -43.99 -54.58 3.71 Favored 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 123.047 2.498 . . . . 0.0 112.759 -179.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.552 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 0.7 OUTLIER -25.27 132.06 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.989 -178.483 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . 0.471 ' HB2' ' HG3' ' B' ' 393' ' ' PRO . 4.5 t -137.94 152.84 49.36 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.795 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 0.982 HG23 HG23 ' B' ' 390' ' ' VAL . 0.3 OUTLIER -114.92 141.21 32.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.067 0.46 . . . . 0.0 111.201 -179.631 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.673 HG21 ' O ' ' B' ' 423' ' ' ALA . 0.2 OUTLIER -106.27 158.24 6.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.431 179.672 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 0.988 ' HB3' HG23 ' B' ' 388' ' ' VAL . 63.4 tt0 -125.47 114.41 18.77 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.884 179.249 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.614 ' HB3' ' CZ ' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -99.8 103.31 14.93 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.278 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.59 ' HA ' ' O ' ' B' ' 410' ' ' THR . 0.1 OUTLIER -144.41 169.36 18.07 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.327 -179.25 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.662 HG11 ' HG ' ' B' ' 385' ' ' LEU . 0.9 OUTLIER -149.76 -177.25 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.336 -178.942 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . 0.514 ' N ' HG23 ' B' ' 406' ' ' VAL . . . 56.57 -104.52 0.38 Allowed Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.658 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -155.25 18.44 0.42 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.874 0.369 . . . . 0.0 110.936 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 169.32 33.55 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 121.001 -0.619 . . . . 0.0 112.284 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.59 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 1.2 m -120.07 111.72 18.24 Favored 'General case' 0 C--O 1.22 -0.498 0 O-C-N 123.0 -0.118 . . . . 0.0 110.756 179.624 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 57.8 t -105.14 104.18 16.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.65 0.262 . . . . 0.0 110.53 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.715 HD13 ' N ' ' B' ' 412' ' ' LEU . 0.0 OUTLIER -62.33 -26.89 68.68 Favored 'General case' 0 CA--C 1.518 -0.253 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 179.345 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . 0.479 ' HA3' ' HB3' ' B' ' 430' ' ' ASN . . . 172.44 -171.57 44.37 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.121 -1.037 . . . . 0.0 113.181 179.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.461 ' O ' ' OD1' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -145.79 147.68 32.13 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.664 -0.268 . . . . 0.0 110.704 -179.671 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.529 ' HA2' ' HG2' ' B' ' 426' ' ' ARG . . . -140.72 150.36 21.64 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 119.9 -1.143 . . . . 0.0 112.936 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . 0.779 ' HB ' HD12 ' B' ' 401' ' ' ILE . 1.6 p -152.02 137.3 10.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.788 0.327 . . . . 0.0 111.355 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.942 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -149.74 177.36 27.93 Favored Glycine 0 C--O 1.226 -0.344 0 C-N-CA 120.856 -0.688 . . . . 0.0 111.962 179.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.496 ' HA ' ' HB3' ' B' ' 399' ' ' ASN . 4.4 ptt85 -85.5 -45.52 11.72 Favored 'General case' 0 C--O 1.232 0.139 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -179.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.684 ' H ' HD11 ' B' ' 422' ' ' ILE . 14.8 t30 -98.85 39.68 1.25 Allowed 'General case' 0 C--O 1.223 -0.332 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.686 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 1.0 OUTLIER 46.34 -47.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 N-CA-C 114.879 1.437 . . . . 0.0 114.879 179.069 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.663 ' N ' ' O ' ' B' ' 419' ' ' ASN . 0.0 OUTLIER -42.35 -58.22 2.28 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 118.378 0.536 . . . . 0.0 109.893 -179.081 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.942 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -46.69 -17.57 0.13 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.567 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.916 178.246 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.686 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -86.49 -49.84 7.29 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . 0.501 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -57.33 -46.48 91.75 Favored Glycine 0 C--N 1.34 0.774 0 C-N-CA 119.824 -1.179 . . . . 0.0 110.781 178.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.593 ' N ' HD12 ' B' ' 425' ' ' ILE . 1.3 mp -66.55 -65.0 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.068 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.615 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -39.7 -31.62 0.11 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.045 178.691 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.58 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -63.7 -59.88 4.02 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 1.006 ' HB1' ' HB1' ' B' ' 370' ' ' ALA . . . -58.95 -54.32 48.43 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 178.296 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.658 ' OE2' ' HB2' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -53.12 -18.09 1.97 Allowed 'General case' 0 C--N 1.334 -0.076 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.339 178.602 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.525 ' ND2' ' O ' ' B' ' 426' ' ' ARG . 0.7 OUTLIER -82.07 -36.39 27.7 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.311 178.985 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.507 ' HA ' ' HB3' ' B' ' 412' ' ' LEU . . . -71.15 -37.17 72.25 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -178.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.865 ' HA ' HD11 ' B' ' 438' ' ' LEU . 0.0 OUTLIER -83.85 12.2 6.44 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.594 -0.442 . . . . 0.0 111.044 179.968 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -99.17 -8.98 24.34 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.389 -179.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.493 ' O ' ' HG ' ' B' ' 438' ' ' LEU . 29.8 t0 -108.68 87.36 2.47 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.068 0.461 . . . . 0.0 111.203 -179.602 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.568 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 0.0 OUTLIER -53.0 -53.15 54.4 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.088 -179.963 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.568 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 7.5 mttm -52.15 -46.72 65.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.99 -179.597 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.479 ' O ' ' HB3' ' B' ' 440' ' ' PHE . 14.3 tmm? -68.4 -50.85 49.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.979 0.419 . . . . 0.0 110.338 179.476 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.865 HD11 ' HA ' ' B' ' 432' ' ' LEU . 58.3 mt -51.73 -62.37 1.67 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.546 179.419 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . 0.451 ' O ' ' HB3' ' B' ' 442' ' ' ALA . 48.9 t0 -57.37 -39.18 75.48 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.232 178.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.48 ' CD1' ' C ' ' B' ' 440' ' ' PHE . 0.0 OUTLIER -45.94 -49.76 15.43 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.189 179.497 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.475 ' HA ' ' HB2' ' B' ' 444' ' ' GLN . 60.8 m-85 -65.15 -37.42 87.34 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.504 179.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . 0.455 ' O ' ' N ' ' B' ' 445' ' ' ARG . . . -45.52 -62.07 1.43 Allowed 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 178.23 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 1.5 ttmt -48.36 -47.66 37.07 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 178.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.967 ' O ' HG23 ' B' ' 448' ' ' ILE . 2.5 mm100 -65.67 -5.7 9.23 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.046 178.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.54 ' O ' ' CG1' ' B' ' 448' ' ' ILE . 0.0 OUTLIER -89.51 -42.25 11.57 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.1 179.79 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -71.46 -31.14 66.82 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.986 179.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . 0.462 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -67.75 -63.63 1.02 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.409 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.967 HG23 ' O ' ' B' ' 444' ' ' GLN . 1.1 pt -27.45 132.77 0.16 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.95 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -74.89 2.6 6.39 Favored 'Trans proline' 0 N--CA 1.465 -0.163 0 C-N-CA 122.821 2.347 . . . . 0.0 112.344 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 39.8 58.0 2.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.69 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 9.3 t -65.0 -40.52 95.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.034 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 70.07 29.64 3.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.982 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.916 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.765 HO2' ' H8 ' ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.42 -2.779 0 C3'-C2'-C1' 104.709 3.566 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.765 ' H8 ' HO2' ' A' ' 1' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.44 2.155 0 O4'-C1'-N19 111.113 2.913 . 0.231 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.579 " O2'" " O5'" ' A' ' 4' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.384 0 C5'-C4'-C3' 111.024 -2.984 . 0.165 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.579 " O5'" " O2'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.425 -2.358 0 C5'-C4'-C3' 111.055 -2.963 . 0.077 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.552 ' H6 ' " O5'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.438 2.002 0 O4'-C1'-N19 111.2 3.0 . 0.194 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.521 ' OP1' ' CG ' ' B' ' 393' ' ' PRO . . . . . . . . 0 O4'--C4' 1.424 -2.426 0 C5'-C4'-C3' 111.099 -2.934 . 0.032 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.582 ' H6 ' " O5'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.22 0 O4'-C1'-N19 111.556 3.356 . 0.175 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.446 ' C6 ' " H2'" ' A' ' 7' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.443 2.433 0 O4'-C1'-N19 111.149 2.949 . 0.269 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.445 " H2'" ' C6 ' ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.334 0 O4'-C1'-N19 111.215 3.015 . 0.108 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.663 ' H6 ' " O5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.436 1.829 0 C5'-C4'-C3' 111.186 -2.876 . 0.086 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.613 " O2'" " O5'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.43 0 O4'-C1'-N19 111.169 2.969 . 0.018 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.763 " O5'" ' H6 ' ' A' ' 12' ' ' ' U' . . . . . . . . 0 P--O5' 1.612 1.935 0 O4'-C1'-N19 111.068 2.868 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.74 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.422 -2.542 0 C3'-C2'-C1' 104.885 3.761 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.696 ' C4 ' ' C4 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.422 -2.554 0 C5'-C4'-C3' 111.165 -2.89 . 0.02 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.719 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.437 1.894 0 O4'-C1'-N19 111.114 2.914 . 0.039 1c . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.719 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.432 -1.772 0 O4'-C1'-N19 111.389 3.189 . 0.3 1b . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.646 ' C2 ' ' NH1' ' B' ' 372' ' ' ARG . . . . . . . . 0 O4'--C4' 1.429 -1.972 0 O4'-C1'-N19 111.344 3.144 OUTLIER-DELTA 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.781 " O5'" ' H8 ' ' A' ' 18' ' ' ' A' . . . . . . . . 0 P--O5' 1.61 1.708 0 C5'-C4'-C3' 110.968 -3.022 . 0.0 OUTLIER delta-1 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.709 " O4'" " H2'" ' A' ' 18' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.428 -2.089 0 C5'-C4'-C3' 111.069 -2.954 . 0.054 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.739 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 P--O5' 1.611 1.846 0 C5'-C4'-C3' 111.071 -2.952 . 0.165 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.709 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.658 0 C3'-C2'-C1' 104.855 3.728 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.831 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.438 1.994 0 O4'-C1'-N19 111.168 2.968 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.781 " H5'" " O2'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.425 -2.334 0 O4'-C1'-N19 111.46 3.26 . 0.048 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.708 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.439 2.107 0 O4'-C1'-N19 110.817 2.617 . 0.098 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . 0.451 ' C6 ' ' C6 ' ' A' ' 26' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.442 2.33 0 O4'-C1'-N19 111.275 3.075 . 0.273 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.563 HO2' " C5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.512 0 O4'-C1'-N19 111.211 3.011 . 0.09 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.88 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.436 1.839 0 O4'-C1'-N19 111.112 2.912 . 0.117 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.88 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.499 0 C3'-C2'-C1' 104.686 3.54 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.796 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.441 2.271 0 O4'-C1'-N19 111.252 3.052 . 0.14 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 1.002 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.227 0 O4'-C1'-N19 111.303 3.103 . 0.458 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 1.002 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.636 0 O4'-C1'-N19 111.108 2.908 . 0.166 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.604 0 O4'-C1'-N19 111.137 2.937 . 0.588 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.108 0 N-CA-C 112.485 -0.246 . . . . 0.0 112.485 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . 0.461 ' HB3' ' HG ' ' B' ' 432' ' ' LEU . 0.0 OUTLIER -121.72 30.49 6.66 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.837 0.351 . . . . 0.0 110.915 179.859 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . 0.792 HD12 ' H ' ' B' ' 367' ' ' ASP . 0.1 OUTLIER -75.34 173.1 11.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.34 179.786 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.792 ' H ' HD12 ' B' ' 366' ' ' LEU . 30.0 t70 -41.93 -77.45 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.333 -0.618 . . . . 0.0 109.333 179.426 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.559 ' HA ' ' CD ' ' B' ' 371' ' ' LYS . 0.0 OUTLIER -36.11 -41.72 0.27 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.52 179.414 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . 0.512 ' N ' ' HG3' ' B' ' 368' ' ' MET . 2.8 m-80 -63.96 -45.82 87.41 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.034 -179.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 1.002 ' HB3' ' HB1' ' B' ' 428' ' ' ALA . . . -61.92 -68.53 0.31 Allowed 'General case' 0 C--O 1.223 -0.322 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 179.441 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.618 ' HE2' ' N3 ' ' A' ' 20' ' ' ' A' . 0.0 OUTLIER -35.64 -44.89 0.34 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.795 0.331 . . . . 0.0 110.547 179.946 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.646 ' NH1' ' C2 ' ' A' ' 17' ' ' ' A' . 0.0 OUTLIER -64.64 -36.03 82.92 Favored 'General case' 0 N--CA 1.462 0.144 0 CA-C-O 121.329 0.585 . . . . 0.0 110.247 179.209 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.963 ' O ' HG23 ' B' ' 378' ' ' ILE . 0.0 OUTLIER -62.51 -46.1 89.95 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.98 179.46 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 1.038 HD12 HD21 ' B' ' 385' ' ' LEU . 0.1 OUTLIER -71.71 -65.73 0.72 Allowed 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -178.126 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . 0.633 ' CE1' HD11 ' B' ' 385' ' ' LEU . 2.5 m-85 -78.96 -7.25 57.87 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.337 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.556 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.2 OUTLIER -128.2 4.13 5.79 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.851 0.686 . . . . 0.0 112.851 -179.12 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.846 HD23 ' CD ' ' B' ' 373' ' ' GLN . 49.4 tp -152.52 -2.74 0.25 Allowed 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 113.669 0.988 . . . . 0.0 113.669 -179.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.963 HG23 ' O ' ' B' ' 373' ' ' GLN . 0.7 OUTLIER -131.52 -51.93 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.101 0 C-N-CA 119.442 -0.903 . . . . 0.0 112.324 179.602 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.795 ' CA ' HD21 ' B' ' 383' ' ' LEU . . . -114.36 -151.45 10.36 Favored Glycine 0 N--CA 1.445 -0.765 0 C-N-CA 119.529 -1.32 . . . . 0.0 113.607 -179.117 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.55 ' CZ ' ' CG2' ' B' ' 448' ' ' ILE . 0.1 OUTLIER -155.09 -84.47 0.06 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.175 -0.513 . . . . 0.0 110.124 -179.389 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -170.59 25.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.692 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . 0.493 ' O ' ' HG2' ' B' ' 384' ' ' ARG . 0.1 OUTLIER -131.73 -43.71 0.99 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.668 0.27 . . . . 0.0 111.034 179.874 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.822 HD12 ' N ' ' B' ' 384' ' ' ARG . 1.1 pp -61.32 -15.01 31.41 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.949 0.404 . . . . 0.0 110.772 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . 0.822 ' N ' HD12 ' B' ' 383' ' ' LEU . 15.0 mmt180 70.1 66.93 0.22 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.693 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 1.038 HD21 HD12 ' B' ' 374' ' ' LEU . 0.0 OUTLIER -102.12 132.8 47.8 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.88 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . 0.986 ' N ' HD22 ' B' ' 385' ' ' LEU . 30.8 p-80 -176.31 -177.39 0.86 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.627 0.727 . . . . 0.0 112.684 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.564 ' CE2' ' HB3' ' B' ' 404' ' ' CYS . 2.6 m-85 -118.96 165.18 14.41 Favored 'General case' 0 CA--C 1.51 -0.584 0 CA-C-N 114.749 -1.114 . . . . 0.0 110.156 178.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . 0.531 HG23 ' CB ' ' B' ' 403' ' ' GLU . 0.0 OUTLIER -149.62 112.3 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 CA-C-O 121.484 0.659 . . . . 0.0 112.047 179.388 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 13.2 m -72.76 130.01 39.51 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.974 179.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 0.828 HG23 HG23 ' B' ' 401' ' ' ILE . 29.6 m -136.96 153.22 29.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.985 -179.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.53 ' CB ' ' O ' ' B' ' 390' ' ' VAL . 0.0 OUTLIER 86.16 28.47 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.351 -179.406 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.507 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.8 OUTLIER -8.58 119.06 0.03 OUTLIER Pre-proline 0 N--CA 1.467 0.41 0 O-C-N 124.148 0.905 . . . . 0.0 112.587 -179.717 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.521 ' CG ' ' OP1' ' A' ' 6' ' ' ' A' . 2.0 Cg_endo -49.09 167.68 0.13 Allowed 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.703 2.269 . . . . 0.0 112.591 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . 0.431 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 52.2 p -150.33 158.86 44.62 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.39 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . . . . . . . . . . . -77.65 5.7 8.72 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 120.962 0.41 . . . . 0.0 111.139 179.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . . . . . . . . . 15.2 m -133.22 12.98 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.535 0.683 . . . . 0.0 109.387 178.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 174.22 56.93 0.03 OUTLIER Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.004 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.51 ' O ' ' C ' ' B' ' 399' ' ' ASN . 60.0 Cg_exo -35.72 -57.1 0.54 Allowed 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 123.081 2.52 . . . . 0.0 112.71 -179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.553 ' HA ' ' O ' ' B' ' 417' ' ' GLY . 2.0 m-20 -13.52 125.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.441 -0.8 . . . . 0.0 112.924 -179.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . . . . . . . . . 38.7 t -132.33 142.37 49.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.781 179.199 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 0.828 HG23 HG23 ' B' ' 390' ' ' VAL . 0.1 OUTLIER -109.6 134.13 52.65 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.321 0 CA-C-O 121.104 0.478 . . . . 0.0 111.328 -179.366 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.908 HG21 ' O ' ' B' ' 423' ' ' ALA . 2.0 t -98.16 154.73 3.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.76 179.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 0.531 ' CB ' HG23 ' B' ' 388' ' ' VAL . 8.4 mm-40 -130.7 104.29 7.1 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.367 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.564 ' HB3' ' CE2' ' B' ' 387' ' ' TYR . 0.0 OUTLIER -92.5 107.22 19.05 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.659 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.521 ' HA ' ' O ' ' B' ' 410' ' ' THR . 10.5 ptm180 -147.21 164.95 31.52 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.894 -179.423 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.6 HG12 ' HA ' ' B' ' 385' ' ' LEU . 1.6 m -144.2 144.44 22.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.01 -179.544 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 68.56 3.86 35.66 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.42 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 67.11 12.31 8.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.704 0.288 . . . . 0.0 110.799 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . -133.68 -5.19 2.91 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.474 -0.869 . . . . 0.0 113.239 -179.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.521 ' O ' ' HA ' ' B' ' 405' ' ' ARG . 63.8 m -130.06 122.98 29.4 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-N 116.992 0.396 . . . . 0.0 111.935 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . . . . . . . . . 9.6 t -107.26 96.07 4.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.834 179.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.554 HD12 ' SD ' ' B' ' 437' ' ' MET . 0.2 OUTLIER -54.53 -21.86 11.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.011 0.434 . . . . 0.0 110.301 179.648 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . . . . . . . . . . . 160.12 -161.51 32.52 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.69 -0.766 . . . . 0.0 112.299 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . 0.504 ' OG1' HD11 ' B' ' 401' ' ' ILE . 8.8 t -160.25 167.68 27.03 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.121 0.486 . . . . 0.0 111.471 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.51 ' O ' ' HA ' ' B' ' 401' ' ' ILE . . . -141.3 154.61 24.69 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.654 -0.784 . . . . 0.0 113.582 -179.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . 0.773 ' CG2' HD12 ' B' ' 401' ' ' ILE . 85.9 t -148.15 100.86 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 120.761 0.315 . . . . 0.0 110.777 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.957 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -113.95 162.53 12.36 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.626 -0.797 . . . . 0.0 111.768 179.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.425 ' HA ' ' CG ' ' B' ' 399' ' ' ASN . 0.0 OUTLIER -83.38 -50.68 8.1 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 117.125 0.462 . . . . 0.0 111.027 179.994 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.952 ' O ' HG23 ' B' ' 420' ' ' ILE . 0.5 OUTLIER -80.01 -23.93 41.17 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 120.972 -0.291 . . . . 0.0 110.767 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.952 HG23 ' O ' ' B' ' 419' ' ' ASN . 1.2 pp 110.54 -39.77 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 C-N-CA 124.523 1.129 . . . . 0.0 110.842 -179.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.558 ' N ' HD12 ' B' ' 420' ' ' ILE . 0.3 OUTLIER -45.86 -63.08 1.06 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.994 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.957 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -45.34 -24.45 0.35 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.282 177.316 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.908 ' O ' HG21 ' B' ' 402' ' ' VAL . . . -72.75 -51.76 17.81 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.092 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . 0.501 ' N ' ' O ' ' B' ' 421' ' ' LYS . . . -64.0 -54.6 29.41 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.25 -0.976 . . . . 0.0 111.322 179.341 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.655 HD13 ' N ' ' B' ' 425' ' ' ILE . 2.1 mm -62.6 -71.08 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.575 0 CA-C-N 115.662 -0.269 . . . . 0.0 111.113 179.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.539 ' CG ' ' O ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -46.34 -25.4 0.63 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.944 0.402 . . . . 0.0 110.83 -178.549 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.702 ' HB2' ' O ' ' B' ' 423' ' ' ALA . . . -62.56 -54.58 37.64 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 176.576 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 1.002 ' HB1' ' HB3' ' B' ' 370' ' ' ALA . . . -53.59 -50.84 64.76 Favored 'General case' 0 C--O 1.243 0.753 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 177.62 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.508 ' HA ' ' CD1' ' B' ' 432' ' ' LEU . 29.2 mt-10 -61.38 -8.54 4.08 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 115.085 -0.962 . . . . 0.0 111.402 179.168 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.537 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 24.8 m120 -86.48 -39.6 16.12 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.537 178.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.561 ' CB ' ' OH ' ' B' ' 387' ' ' TYR . . . -70.87 -34.39 71.56 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 -179.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.722 ' CD1' ' HB2' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -85.82 14.51 5.86 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.383 -0.527 . . . . 0.0 111.356 -179.897 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 8.2 ttt180 -94.89 -3.71 48.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.178 -179.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.548 ' CB ' ' HB3' ' B' ' 437' ' ' MET . 18.2 m-20 -113.59 73.1 0.8 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.328 -179.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.555 ' CG ' ' N ' ' B' ' 436' ' ' LYS . 6.5 ptmt -41.89 -52.65 4.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.856 0.36 . . . . 0.0 110.579 179.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.555 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 1.4 mtpp -55.87 -45.17 78.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.212 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.554 ' SD ' HD12 ' B' ' 412' ' ' LEU . 15.5 tmm? -65.82 -52.3 51.75 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.082 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.941 HD22 ' NE2' ' B' ' 373' ' ' GLN . 24.3 mt -53.62 -65.37 0.58 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.617 179.297 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -46.51 -49.09 18.99 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.731 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.534 ' CE2' ' CZ ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -48.37 -42.23 31.04 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.532 0.682 . . . . 0.0 109.377 179.999 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.589 ' CB ' ' HB ' ' B' ' 378' ' ' ILE . 45.4 m-85 -73.02 -37.88 66.76 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.2 179.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . . . . . . . . . . . -51.7 -59.47 4.25 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 3.4 ttmt -49.08 -45.24 42.82 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 108.744 -0.836 . . . . 0.0 108.744 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.504 ' HB2' ' HA ' ' B' ' 441' ' ' TYR . 0.0 OUTLIER -54.11 -49.04 70.04 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.058 178.543 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.798 ' O ' HD11 ' B' ' 448' ' ' ILE . 0.1 OUTLIER -57.72 -27.71 63.21 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.048 179.786 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -74.83 -41.61 59.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.976 0.417 . . . . 0.0 110.509 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . 0.478 ' O ' ' C ' ' B' ' 448' ' ' ILE . . . -70.4 -78.75 0.07 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.124 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.798 HD11 ' O ' ' B' ' 445' ' ' ARG . 0.2 OUTLIER 23.56 95.39 0.04 OUTLIER Pre-proline 0 N--CA 1.463 0.212 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.767 -179.844 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . 0.445 ' O ' ' HB2' ' B' ' 450' ' ' ARG . 50.3 Cg_endo -84.45 117.19 2.07 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 123.085 2.523 . . . . 0.0 112.306 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . 0.445 ' HB2' ' O ' ' B' ' 449' ' ' PRO . 0.0 OUTLIER 177.66 -67.15 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.139 -179.93 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -105.95 -22.33 12.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.174 -179.69 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . . . . . . . . . 6.3 mp0 -137.61 108.81 6.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.935 0.398 . . . . 0.0 111.051 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 28.7 t . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.858 179.971 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ' G' . . . . . 0.533 HO5' ' H8 ' ' A' ' 1' ' ' ' G' . . . . . . . . 0 C2'--C1' 1.511 -1.673 0 C5'-C4'-C3' 110.867 -3.089 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ' G' . . . . . 0.757 " O2'" " H5'" ' A' ' 3' ' ' ' G' . . . . . . . . 0 O4'--C1' 1.441 2.222 0 O4'-C1'-N19 111.185 2.985 . 0.119 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ' G' . . . . . 0.757 " H5'" " O2'" ' A' ' 2' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.389 0 O4'-C1'-N19 111.144 2.944 . 0.117 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ' A' . . . . . 0.514 " H2'" ' C6 ' ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.328 0 O4'-C1'-N19 110.965 2.765 . 0.11 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ' U' . . . . . 0.62 " O2'" " H5'" ' A' ' 6' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.439 2.094 0 C5'-C4'-C3' 111.16 -2.893 . 0.096 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ' A' . . . . . 0.62 " H5'" " O2'" ' A' ' 5' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.425 -2.313 0 C5'-C4'-C3' 111.177 -2.882 . 0.33 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ' C' . . . . . 0.548 ' C4 ' ' N4 ' ' A' ' 8' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.421 -2.669 0 C3'-C2'-C1' 104.9 3.778 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ' C' . . . . . 0.564 " O2'" " O5'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.42 -2.747 0 C3'-C2'-C1' 104.823 3.693 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ' A' . . . . . 0.876 " O2'" " H5'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.214 0 O4'-C1'-N19 111.281 3.081 . 0.064 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ' U' . . . . . 0.876 " H5'" " O2'" ' A' ' 9' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.421 -2.696 0 C3'-C2'-C1' 104.662 3.513 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ' G' . . . . . 0.599 " O5'" " O2'" ' A' ' 10' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.491 0 C5'-C4'-C3' 111.05 -2.966 . 0.038 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ' U' . . . . . 0.897 " O5'" ' H6 ' ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.435 1.759 0 C5'-C4'-C3' 110.802 -3.132 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ' U' . . . . . 0.779 " H5'" " O2'" ' A' ' 12' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.423 -2.489 0 C3'-C2'-C1' 104.885 3.761 . 0.0 OUTLIER '7D dist 1a' 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ' C' . . . . . 0.677 " H2'" " O4'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.425 -2.339 0 C5'-C4'-C3' 111.147 -2.902 . 0.087 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ' A' . . . . . 0.949 " H2'" " O4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.426 0 C5'-C4'-C3' 111.068 -2.955 . 0.0 OUTLIER '7D dist 1c' 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ' G' . . . . . 0.949 " O4'" " H2'" ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.427 0 C5'-C4'-C3' 110.7 -3.2 OUTLIER-EPSILON 0.0 OUTLIER delta 0.0 . . . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ' A' . . . . . 0.636 ' OP2' " H4'" ' A' ' 16' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.424 -2.436 0 C3'-C2'-C1' 104.209 3.01 . 0.0 OUTLIER epsilon-1 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ' A' . . . . . 0.6 ' N6 ' ' N3 ' ' A' ' 15' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.438 2.026 0 O4'-C1'-N19 110.852 2.652 . 0.0 OUTLIER gamma 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ' G' . . . . . 0.55 ' H21' ' NH2' ' B' ' 372' ' ' ARG . . . . . . . . 0 O4'--C4' 1.426 -2.21 0 C5'-C4'-C3' 111.172 -2.886 . 0.397 1L . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ' A' . . . . . 0.739 " O5'" ' H8 ' ' A' ' 20' ' ' ' A' . . . . . . . . 0 P--O5' 1.612 1.884 0 C5'-C4'-C3' 111.197 -2.869 . 0.191 &a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ' A' . . . . . 0.729 " H5'" " O2'" ' A' ' 20' ' ' ' A' . . . . . . . . 0 O4'--C4' 1.424 -2.457 0 C3'-C2'-C1' 104.612 3.457 . 0.013 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ' C' . . . . . 0.899 ' H6 ' " O5'" ' A' ' 22' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.436 1.869 0 O4'-C1'-N19 111.028 2.828 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ' G' . . . . . 0.779 " O2'" " H5'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.44 2.126 0 O4'-C1'-N19 111.323 3.123 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ' U' . . . . . 0.779 " H5'" " O2'" ' A' ' 23' ' ' ' G' . . . . . . . . 0 O4'--C4' 1.422 -2.615 0 C3'-C2'-C1' 104.854 3.726 . 0.01 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ' G' . . . . . 0.608 " O5'" " O2'" ' A' ' 24' ' ' ' U' . . . . . . . . 0 O4'--C1' 1.441 2.28 0 O4'-C1'-N19 110.998 2.798 . 0.034 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ' G' . . . . . 0.706 " O2'" " H5'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.424 -2.384 0 O4'-C1'-N19 111.159 2.959 . 0.454 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ' U' . . . . . 0.707 " O2'" " H5'" ' A' ' 28' ' ' ' A' . . . . . . . . 0 O4'--C1' 1.442 2.294 0 O4'-C1'-N19 111.367 3.167 . 0.179 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ' A' . . . . . 0.707 " H5'" " O2'" ' A' ' 27' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.421 -2.665 0 C3'-C2'-C1' 104.692 3.547 . 0.024 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ' U' . . . . . 0.881 " O2'" " H5'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C1' 1.442 2.343 0 O4'-C1'-N19 111.169 2.969 . 0.184 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ' C' . . . . . 0.952 " O2'" " H5'" ' A' ' 31' ' ' ' U' . . . . . . . . 0 O4'--C4' 1.426 -2.239 0 O4'-C1'-N19 111.514 3.314 . 0.123 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ' U' . . . . . 0.952 " H5'" " O2'" ' A' ' 30' ' ' ' C' . . . . . . . . 0 O4'--C4' 1.422 -2.611 0 O4'-C1'-N19 111.244 3.044 . 0.171 1a . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ' C' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.703 0 C5'-C4'-C3' 111.123 -2.918 . 0.508 1a . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 364' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.261 0 N-CA-C 112.469 -0.252 . . . . 0.0 112.469 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 365' ' ' SER . . . . . 0.462 ' HB2' ' OE2' ' B' ' 429' ' ' GLU . 12.1 m -90.28 47.52 1.45 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.917 0.389 . . . . 0.0 110.822 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 366' ' ' LEU . . . . . 0.513 ' O ' ' HB2' ' B' ' 369' ' ' ASN . 6.7 tp -41.18 150.49 0.08 Allowed 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.982 179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 367' ' ' ASP . . . . . 0.479 ' HB3' HG13 ' B' ' 425' ' ' ILE . 1.0 OUTLIER -46.84 -72.86 0.05 OUTLIER 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 179.133 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 368' ' ' MET . . . . . 0.559 ' SD ' ' N1 ' ' A' ' 18' ' ' ' A' . 3.5 tmm? -34.41 -42.48 0.14 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.773 179.591 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 369' ' ' ASN . . . . . 0.545 ' N ' ' HE3' ' B' ' 368' ' ' MET . 90.7 m-20 -59.99 -50.5 73.49 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-O 120.8 0.333 . . . . 0.0 110.704 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 370' ' ' ALA . . . . . 0.71 ' HB1' ' CB ' ' B' ' 428' ' ' ALA . . . -56.38 -68.31 0.22 Allowed 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 178.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 371' ' ' LYS . . . . . 0.425 ' C ' ' O ' ' B' ' 370' ' ' ALA . 2.5 mttm -33.85 -51.3 0.4 Allowed 'General case' 0 C--O 1.238 0.473 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.9 179.809 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 372' ' ' ARG . . . . . 0.591 ' O ' ' CB ' ' B' ' 376' ' ' SER . 0.2 OUTLIER -56.64 -38.33 71.98 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.712 -179.843 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 373' ' ' GLN . . . . . 0.56 ' N ' ' O ' ' B' ' 370' ' ' ALA . 0.0 OUTLIER -62.87 -57.14 11.85 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.696 0.76 . . . . 0.0 110.159 178.955 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 374' ' ' LEU . . . . . 1.091 HD11 ' CB ' ' B' ' 428' ' ' ALA . 1.8 mt -48.8 -74.75 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 -178.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 375' ' ' TYR . . . . . . . . . . . . . 1.5 m-30 -98.14 4.39 49.05 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 114.131 1.16 . . . . 0.0 114.131 -176.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 376' ' ' SER . . . . . 0.591 ' CB ' ' O ' ' B' ' 372' ' ' ARG . 0.1 OUTLIER -116.2 -2.04 12.26 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.077 0.465 . . . . 0.0 110.211 178.705 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 377' ' ' LEU . . . . . 0.544 ' HB2' ' HA ' ' B' ' 373' ' ' GLN . 0.4 OUTLIER -133.42 -39.04 0.92 Allowed 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.082 177.901 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 378' ' ' ILE . . . . . 0.436 ' C ' ' O ' ' B' ' 374' ' ' LEU . 0.7 OUTLIER -127.15 -142.79 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.672 179.501 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 379' ' ' GLY . . . . . 0.51 ' O ' ' O ' ' B' ' 380' ' ' TYR . . . 93.26 -22.62 33.85 Favored Glycine 0 C--N 1.332 0.342 0 C-N-CA 120.535 -0.84 . . . . 0.0 113.139 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 380' ' ' TYR . . . . . 0.633 ' CD2' ' HB3' ' B' ' 383' ' ' LEU . 0.2 OUTLIER 36.93 -175.23 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 115.258 1.577 . . . . 0.0 115.258 179.57 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 381' ' ' ALA . . . . . . . . . . . . . . . -123.42 -21.46 5.31 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 113.734 -1.575 . . . . 0.0 111.183 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 382' ' ' SER . . . . . . . . . . . . . 37.9 t -160.14 44.84 0.22 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.136 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 383' ' ' LEU . . . . . 0.818 ' C ' HD13 ' B' ' 383' ' ' LEU . 0.0 OUTLIER -114.05 -3.99 13.24 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.861 0.362 . . . . 0.0 111.018 178.749 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 384' ' ' ARG . . . . . 0.777 ' N ' HD13 ' B' ' 383' ' ' LEU . 11.9 tpt180 75.86 71.63 0.08 Allowed 'General case' 0 C--O 1.227 -0.127 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 178.327 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 385' ' ' LEU . . . . . 0.661 ' HB2' HD11 ' B' ' 383' ' ' LEU . 7.3 tt -135.32 123.88 23.57 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.451 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 386' ' ' HIS . . . . . 0.492 ' N ' HD23 ' B' ' 385' ' ' LEU . 7.5 p-80 -158.91 146.17 17.47 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 -178.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 387' ' ' TYR . . . . . 0.745 ' CZ ' HD13 ' B' ' 374' ' ' LEU . 39.2 m-85 -96.56 132.77 41.82 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 114.095 -1.411 . . . . 0.0 110.823 178.172 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 388' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -122.17 130.82 74.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.52 179.575 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 2.1 m -91.96 121.17 33.3 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.291 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 390' ' ' VAL . . . . . 1.01 HG23 HG23 ' B' ' 401' ' ' ILE . 27.5 m -128.9 152.35 36.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.309 -179.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 391' ' ' LYS . . . . . 0.65 ' HB2' HG22 ' B' ' 401' ' ' ILE . 4.7 tmtt? 87.66 24.87 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.311 179.572 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 392' ' ' LYS . . . . . 0.542 ' C ' ' O ' ' B' ' 391' ' ' LYS . 0.2 OUTLIER -4.72 116.95 0.02 OUTLIER Pre-proline 0 N--CA 1.473 0.696 0 O-C-N 124.016 0.822 . . . . 0.0 111.962 -179.964 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 393' ' ' PRO . . . . . 0.554 ' CG ' HG21 ' B' ' 420' ' ' ILE . 15.7 Cg_exo -65.35 162.03 35.31 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.351 2.034 . . . . 0.0 112.542 -179.345 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . 0.456 ' H ' ' HA ' ' B' ' 398' ' ' PRO . 2.3 p -150.08 164.82 34.56 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.478 -0.783 . . . . 0.0 112.022 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 395' ' ' ALA . . . . . 0.512 ' CB ' ' O2 ' ' A' ' 29' ' ' ' U' . . . -81.6 5.29 18.57 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.603 179.451 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 396' ' ' VAL . . . . . 0.591 HG23 ' OD2' ' B' ' 397' ' ' ASP . 26.1 m -123.41 11.54 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 CA-C-O 121.53 0.681 . . . . 0.0 109.462 178.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 397' ' ' ASP . . . . . 0.591 ' OD2' HG23 ' B' ' 396' ' ' VAL . 2.0 p30 163.95 59.33 0.0 OUTLIER Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 114.803 -1.089 . . . . 0.0 109.841 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 398' ' ' PRO . . . . . 0.541 ' HB2' ' O ' ' B' ' 418' ' ' ARG . 21.5 Cg_exo -32.91 -57.4 0.31 Allowed 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 123.069 2.513 . . . . 0.0 112.368 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 399' ' ' ASN . . . . . 0.52 ' C ' ' O ' ' B' ' 398' ' ' PRO . 15.7 m120 -5.23 120.77 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 114.948 -1.023 . . . . 0.0 112.256 179.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 400' ' ' SER . . . . . 0.512 ' CB ' ' HG3' ' B' ' 393' ' ' PRO . 0.3 OUTLIER -144.15 139.4 28.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.886 179.949 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 401' ' ' ILE . . . . . 1.01 HG23 HG23 ' B' ' 390' ' ' VAL . 1.9 tp -110.34 143.46 20.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.717 -179.537 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 402' ' ' VAL . . . . . 0.68 ' HB ' ' HB2' ' B' ' 427' ' ' ALA . 0.4 OUTLIER -112.78 148.99 15.41 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.651 -179.568 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 403' ' ' GLU . . . . . 0.517 ' OE1' HG11 ' B' ' 411' ' ' VAL . 2.1 mm-40 -127.74 128.72 45.86 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.745 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 404' ' ' CYS . . . . . 0.606 ' HB3' ' HA3' ' B' ' 413' ' ' GLY . 18.7 t -118.85 104.86 10.94 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 177.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.571 ' HB2' HG22 ' B' ' 411' ' ' VAL . 3.1 ttp180 -110.96 158.2 19.03 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 124.126 0.891 . . . . 0.0 111.666 -178.3 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 406' ' ' VAL . . . . . 0.683 HG23 ' HB ' ' B' ' 410' ' ' THR . 0.0 OUTLIER -154.7 159.62 3.0 Favored 'Isoleucine or valine' 0 C--O 1.235 0.323 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.668 -179.6 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 407' ' ' GLY . . . . . . . . . . . . . . . 64.93 -94.82 0.18 Allowed Glycine 0 CA--C 1.518 0.259 0 CA-C-N 115.173 -0.921 . . . . 0.0 113.211 179.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 408' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -141.61 20.55 2.19 Favored 'General case' 0 C--N 1.332 -0.16 0 N-CA-C 111.555 0.206 . . . . 0.0 111.555 -179.392 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 409' ' ' GLY . . . . . . . . . . . . . . . 151.82 -14.46 0.79 Allowed Glycine 0 C--N 1.33 0.195 0 C-N-CA 120.234 -0.984 . . . . 0.0 112.96 179.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 410' ' ' THR . . . . . 0.683 ' HB ' HG23 ' B' ' 406' ' ' VAL . 95.0 m -53.58 108.77 0.37 Allowed 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.662 -0.495 . . . . 0.0 109.662 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 411' ' ' VAL . . . . . 0.571 HG22 ' HB2' ' B' ' 405' ' ' ARG . 24.2 t -124.07 106.61 17.21 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.742 0 CA-C-O 122.006 0.908 . . . . 0.0 111.523 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.461 ' O ' ' HB3' ' B' ' 430' ' ' ASN . 0.0 OUTLIER -102.62 -38.99 7.26 Favored 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 113.704 -1.589 . . . . 0.0 108.942 -179.878 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 413' ' ' GLY . . . . . 0.606 ' HA3' ' HB3' ' B' ' 404' ' ' CYS . . . -72.23 98.64 0.82 Allowed Glycine 0 C--N 1.333 0.367 0 C-N-CA 120.069 -1.062 . . . . 0.0 112.535 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 414' ' ' THR . . . . . . . . . . . . . 3.7 m -134.79 93.68 3.06 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 415' ' ' GLY . . . . . 0.804 ' O ' HD12 ' B' ' 401' ' ' ILE . . . -133.71 147.3 18.99 Favored Glycine 0 C--O 1.226 -0.363 0 C-N-CA 119.523 -1.322 . . . . 0.0 114.394 -178.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 416' ' ' VAL . . . . . . . . . . . . . 10.5 p -127.87 154.1 38.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.312 -0.444 . . . . 0.0 110.173 179.566 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.873 ' HA3' HD13 ' B' ' 422' ' ' ILE . . . -165.1 155.72 27.27 Favored Glycine 0 CA--C 1.518 0.245 0 C-N-CA 119.948 -1.12 . . . . 0.0 113.039 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 418' ' ' ARG . . . . . 0.541 ' O ' ' HB2' ' B' ' 398' ' ' PRO . 0.0 OUTLIER -70.77 -41.98 71.0 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.867 0.365 . . . . 0.0 111.361 -179.939 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 419' ' ' ASN . . . . . 0.808 ' H ' HD11 ' B' ' 422' ' ' ILE . 0.1 OUTLIER -100.36 23.97 9.46 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 178.184 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 420' ' ' ILE . . . . . 0.759 ' O ' ' HB3' ' B' ' 423' ' ' ALA . 0.6 OUTLIER 56.51 -43.09 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 N-CA-C 114.101 1.149 . . . . 0.0 114.101 179.247 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 421' ' ' LYS . . . . . 0.626 ' HD3' ' N ' ' B' ' 422' ' ' ILE . 0.0 OUTLIER -45.17 -57.71 3.74 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 179.282 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 422' ' ' ILE . . . . . 0.873 HD13 ' HA3' ' B' ' 417' ' ' GLY . 0.0 OUTLIER -45.78 -26.76 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.51 -0.56 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.601 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.759 ' HB3' ' O ' ' B' ' 420' ' ' ILE . . . -77.26 -47.92 18.85 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 177.233 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 424' ' ' GLY . . . . . 0.59 ' O ' ' HB3' ' B' ' 427' ' ' ALA . . . -57.89 -53.48 45.02 Favored Glycine 0 N--CA 1.447 -0.58 0 N-CA-C 110.058 -1.217 . . . . 0.0 110.058 178.079 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 425' ' ' ILE . . . . . 0.479 HG13 ' HB3' ' B' ' 367' ' ' ASP . 0.7 OUTLIER -59.15 -67.67 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.289 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 177.653 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 426' ' ' ARG . . . . . 0.567 ' CB ' ' O ' ' B' ' 422' ' ' ILE . 3.5 tpt180 -35.86 -33.76 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.201 179.213 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 427' ' ' ALA . . . . . 0.68 ' HB2' ' HB ' ' B' ' 402' ' ' VAL . . . -63.33 -58.17 7.98 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.512 178.478 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 428' ' ' ALA . . . . . 1.091 ' CB ' HD11 ' B' ' 374' ' ' LEU . . . -58.25 -53.87 53.35 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 178.476 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 429' ' ' GLU . . . . . 0.542 ' HA ' HD21 ' B' ' 432' ' ' LEU . 1.1 tt0 -49.14 -25.02 1.9 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.365 178.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 430' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' B' ' 427' ' ' ALA . 2.4 m-80 -78.34 -36.89 45.61 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.477 179.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 431' ' ' ALA . . . . . 0.497 ' O ' ' CE ' ' B' ' 437' ' ' MET . . . -67.73 -41.77 82.94 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.487 -179.372 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 432' ' ' LEU . . . . . 0.827 ' HA ' HD21 ' B' ' 438' ' ' LEU . 0.6 OUTLIER -81.05 6.88 12.24 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.041 -179.839 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 433' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.47 -10.75 59.97 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.711 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 434' ' ' ASP . . . . . 0.501 ' HB3' ' HB3' ' B' ' 437' ' ' MET . 0.8 OUTLIER -126.25 89.95 3.1 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.609 -0.437 . . . . 0.0 112.009 -178.991 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 435' ' ' LYS . . . . . 0.599 ' HA ' HD12 ' B' ' 438' ' ' LEU . 12.4 ptmt -53.79 -51.36 63.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.2 179.198 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 436' ' ' LYS . . . . . 0.561 ' N ' ' CG ' ' B' ' 435' ' ' LYS . 0.0 OUTLIER -51.95 -36.23 48.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.144 179.834 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 437' ' ' MET . . . . . 0.501 ' HB3' ' HB3' ' B' ' 434' ' ' ASP . 14.9 tmm? -76.75 -50.47 13.5 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.944 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 438' ' ' LEU . . . . . 0.827 HD21 ' HA ' ' B' ' 432' ' ' LEU . 23.0 mt -53.02 -64.04 0.95 Allowed 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.735 0.779 . . . . 0.0 110.162 178.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 439' ' ' ASP . . . . . 0.525 ' O ' ' N ' ' B' ' 442' ' ' ALA . 6.1 t70 -50.55 -50.04 54.43 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.894 -1.048 . . . . 0.0 109.736 179.11 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 440' ' ' PHE . . . . . 0.43 ' HB3' ' O ' ' B' ' 436' ' ' LYS . 0.1 OUTLIER -43.03 -38.58 2.35 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.777 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 441' ' ' TYR . . . . . 0.526 ' O ' ' CG ' ' B' ' 444' ' ' GLN . 48.1 m-85 -74.33 -31.43 62.44 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.863 179.456 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 442' ' ' ALA . . . . . 0.525 ' N ' ' O ' ' B' ' 439' ' ' ASP . . . -59.01 -60.65 3.53 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 177.451 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 443' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.9 -37.47 19.84 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 178.104 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 444' ' ' GLN . . . . . 0.662 ' HG3' ' N ' ' B' ' 445' ' ' ARG . 0.0 OUTLIER -62.17 -47.14 85.82 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.364 -0.976 . . . . 0.0 108.364 178.384 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 445' ' ' ARG . . . . . 0.693 ' O ' HD11 ' B' ' 448' ' ' ILE . 0.0 OUTLIER -50.06 -35.1 23.77 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.083 179.589 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 446' ' ' ALA . . . . . . . . . . . . . . . -86.63 -39.95 15.61 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.481 -179.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 447' ' ' ALA . . . . . . . . . . . . . . . -50.65 -45.45 57.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.912 -179.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 448' ' ' ILE . . . . . 0.693 HD11 ' O ' ' B' ' 445' ' ' ARG . 0.9 OUTLIER -42.75 122.3 2.9 Favored Pre-proline 0 C--N 1.324 -0.54 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.683 179.717 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 449' ' ' PRO . . . . . 0.446 ' O ' ' O ' ' B' ' 448' ' ' ILE . 84.7 Cg_exo -46.36 -176.19 0.0 OUTLIER 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.797 2.331 . . . . 0.0 112.698 -179.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 450' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.96 170.86 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.619 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 451' ' ' SER . . . . . 0.43 ' O ' ' C ' ' B' ' 452' ' ' GLU . 1.3 m -57.96 96.14 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.576 179.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 452' ' ' GLU . . . . . 0.43 ' C ' ' O ' ' B' ' 451' ' ' SER . 0.2 OUTLIER 35.79 90.99 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.971 -179.674 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 453' ' ' SER . . . . . . . . . . . . . 13.8 t . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.931 179.954 . . . . . . . . 0 0 . 1 stop_ save_