data_2mro_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 2mro _Structure_validation_residue.Date_analyzed 2016-10-08 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 ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.7 ptt? . . . . . 0 N--CA 1.484 1.251 0 N-CA-C 110.463 -0.199 . . . . 1.6499999999999999 110.463 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 55.0 mm-40 -109.4 143.06 39.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.468 0.175 . . . . 2.04 110.764 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 25.0 pt -128.7 162.83 34.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.473 -0.331 . . . . 1.48 110.535 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -118.34 112.23 19.77 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.429 -0.35 . . . . 2.1699999999999999 110.921 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.1 t -98.86 114.58 37.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.298 -0.41 . . . . 1.6499999999999999 110.602 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -86.91 125.91 34.34 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.29 -0.414 . . . . 3.5099999999999998 111.132 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.17 162.15 13.49 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.045 -0.525 . . . . 2.1699999999999999 109.797 179.376 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 85.5 mt -64.56 -11.03 30.3 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 112.235 0.457 . . . . 3.0499999999999998 112.235 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.25 11.94 34.68 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.217 -0.447 . . . . 2.7000000000000002 111.077 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.16 28.27 70.47 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 121.195 -0.526 . . . . 2.6400000000000001 112.641 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -101.26 143.84 30.84 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 110.511 -0.181 . . . . 2.5600000000000001 110.511 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.6 m -107.46 105.04 14.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.055 0.455 . . . . 2.4100000000000001 110.858 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 70.9 mt -86.1 114.44 25.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.86 -0.609 . . . . 1.8300000000000001 109.891 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.7 m -96.33 113.69 25.3 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.739 -0.467 . . . . 2.1899999999999999 109.739 179.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.6 mt -122.64 156.63 33.92 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.97 0.414 . . . . 1.3600000000000001 111.732 -179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -101.01 119.36 38.63 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.458 -0.792 . . . . 2.3999999999999999 109.685 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.2 m -142.22 -171.86 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 116.101 -0.5 . . . . 1.25 110.042 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -152.55 156.32 33.26 Favored Pre-proline 0 C--N 1.322 -0.604 0 N-CA-C 107.903 -1.147 . . . . 1.8500000000000001 107.903 179.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -51.89 -35.16 58.79 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 122.422 2.081 . . . . 1.78 112.003 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.8 m -75.06 8.33 2.65 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.931 0.715 . . . . 2.1200000000000001 112.931 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -92.41 147.96 22.49 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 122.187 -0.321 . . . . 1.25 110.451 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -93.96 152.04 19.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.317 -0.401 . . . . 1.77 110.652 -179.515 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 49.8 mm -58.05 -43.17 84.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.398 -0.364 . . . . 1.0600000000000001 110.411 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -57.88 -37.59 74.24 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.107 -0.497 . . . . 2.2200000000000002 110.861 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 56.2 t30 -72.67 -37.26 67.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.34 -0.391 . . . . 1.3300000000000001 110.594 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 92.7 t -63.51 -46.95 93.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.199 -0.455 . . . . 0.67000000000000004 110.016 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.419 ' HZ1' ' CG ' ' A' ' 52' ' ' ASP . 19.4 mtmt -64.51 -31.87 73.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.11 -0.496 . . . . 1.6899999999999999 110.72 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.62 -36.61 83.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.165 -0.47 . . . . 1.0800000000000001 110.082 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -68.7 -40.34 80.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.986 -0.552 . . . . 1.48 109.744 179.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 50.3 mt -66.67 -38.96 82.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.991 -0.55 . . . . 1.3100000000000001 109.586 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.29 -36.53 80.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.396 -0.82 . . . . 2.0899999999999999 111.922 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -72.2 -38.77 68.98 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.811 0.671 . . . . 2.0499999999999998 112.811 -178.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -87.03 -43.93 11.96 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 113.208 0.818 . . . . 2.5099999999999998 113.208 -178.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -82.67 -22.2 34.68 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.707 0.632 . . . . 2.1400000000000001 112.707 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 73.92 26.36 69.22 Favored Glycine 0 CA--C 1.517 0.197 0 C-N-CA 120.694 -0.765 . . . . 2.0099999999999998 112.279 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 80.2 mt -108.12 128.28 26.03 Favored Pre-proline 0 C--N 1.326 -0.449 0 N-CA-C 110.106 -0.331 . . . . 1.8300000000000001 110.106 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -55.21 132.78 54.31 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.908 2.405 . . . . 2.04 111.999 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -57.91 -22.59 55.14 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 123.031 2.487 . . . . 1.52 112.92 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.62 -29.56 67.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.766 0.317 . . . . 2.9500000000000002 111.412 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -94.16 -3.79 50.3 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.288 -0.414 . . . . 2.73 110.534 -179.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -86.48 107.89 18.28 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.959 -0.564 . . . . 1.4399999999999999 111.5 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 12.0 mmt85 -109.76 109.01 19.57 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.221 -0.659 . . . . 2.9399999999999999 109.221 178.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 30.9 mt -87.07 136.61 32.86 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.016 0.436 . . . . 1.02 112.159 -179.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.1 mt -122.41 145.09 29.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.688 -0.687 . . . . 2.1400000000000001 110.298 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -133.92 97.33 3.86 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.952 -0.567 . . . . 1.71 109.507 178.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 61.35 40.98 13.6 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.764 -0.653 . . . . 2.1000000000000001 111.99 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.12 -5.94 84.17 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 120.949 -0.643 . . . . 1.8400000000000001 113.775 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -103.36 136.27 43.42 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.858 0.329 . . . . 3.4300000000000002 110.545 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -78.61 136.42 37.5 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.618 0.247 . . . . 2.7200000000000002 110.408 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 71.4 mt -93.88 137.25 33.31 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.916 0.389 . . . . 1.1699999999999999 111.383 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -87.9 132.21 34.29 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.116 -0.493 . . . . 2.6499999999999999 109.731 179.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.419 ' CG ' ' HZ1' ' A' ' 27' ' ' LYS . 4.1 m-20 -59.37 -32.07 69.79 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 112.906 0.706 . . . . 1.8300000000000001 112.906 -179.106 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -87.71 33.12 4.03 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.762 -0.732 . . . . 1.8200000000000001 113.697 -179.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.4 mmt180 -131.46 171.33 13.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.809 0.337 . . . . 2.9300000000000002 110.339 179.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 67.6 p -109.09 168.61 9.24 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.285 -0.635 . . . . 1.71 109.285 179.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 65.8 mt -66.88 -29.23 69.08 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.98 0.419 . . . . 1.49 110.139 179.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.78 -25.87 65.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.959 -0.564 . . . . 2.1000000000000001 111.226 179.303 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -62.99 -26.76 69.01 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.39 -0.368 . . . . 2.0299999999999998 111.658 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -112.7 9.03 19.17 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.26 -0.427 . . . . 1.76 109.999 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 58.24 39.39 25.77 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.436 -0.802 . . . . 3.3700000000000001 111.314 -179.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 78.0 mt -76.0 109.94 10.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.807 -0.633 . . . . 1.6499999999999999 110.046 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -99.0 -172.42 2.28 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.85 -0.614 . . . . 2.79 111.186 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -68.6 151.01 47.32 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.246 -0.434 . . . . 3.52 112.077 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 65.54 22.08 11.78 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.367 -0.833 . . . . 3.1200000000000001 112.98 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.3 m -87.83 145.7 25.95 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.741 0.305 . . . . 1.8999999999999999 110.299 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.2 m -95.36 128.51 42.27 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.145 -0.479 . . . . 2.1600000000000001 111.597 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.8 mp -119.48 143.59 47.45 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.422 -0.955 . . . . 1.4199999999999999 108.422 178.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 46.9 m80 -105.33 149.22 26.25 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 120.534 0.207 . . . . 3.1499999999999999 110.729 -179.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 54.8 tp -126.76 111.09 13.83 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.064 0.459 . . . . 1.54 111.512 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 4.5 t -101.09 129.4 52.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.978 -0.555 . . . . 1.79 110.076 178.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.8 mt -86.18 97.14 10.18 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.063 -0.517 . . . . 2.4300000000000002 109.649 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 55.3 ttt-85 -89.62 106.28 18.35 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.098 0.475 . . . . 3.5 111.17 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 57.1 mt -84.75 -169.22 2.53 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.738 -0.664 . . . . 2.9900000000000002 110.207 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 . . . . . 0 C--N 1.323 -0.566 0 N-CA-C 110.012 -0.366 . . . . 3.9199999999999999 110.012 179.667 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 . . . . . 0 C--O 1.233 0.201 0 N-CA-C 110.095 -0.335 . . . . 2.5499999999999998 110.095 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -66.14 125.74 14.6 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.894 2.396 . . . . 3.77 111.419 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -52.68 -49.39 65.37 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 112.499 0.555 . . . . 5.3600000000000003 112.499 -178.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -53.55 -52.87 58.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 6.8899999999999997 111.655 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.08 -36.55 83.48 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.622 0.601 . . . . 4.2000000000000002 112.622 -178.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 395' ' ' ILE . . . . . . . . . . . . . 89.1 mt -58.3 -48.84 83.83 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 N-CA-C 109.585 -0.524 . . . . 3.7999999999999998 109.585 178.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -62.98 -40.14 96.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.603 -0.726 . . . . 6.5800000000000001 110.641 179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -62.5 -47.7 82.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.16 -0.473 . . . . 7.46 110.983 179.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 95.4 mt -64.8 -41.97 95.4 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.354 -0.384 . . . . 4.3099999999999996 111.548 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 57.7 mtp -69.55 -31.6 69.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.895 0.379 . . . . 5.7999999999999998 111.406 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -66.01 -18.84 65.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.943 -0.571 . . . . 7.71 111.381 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 16.8 mt -78.51 2.28 19.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.971 -0.559 . . . . 5.6900000000000004 110.933 179.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 93.2 41.12 4.65 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.927 -0.654 . . . . 5.8700000000000001 111.844 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -132.1 146.18 60.57 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 120.524 0.202 . . . . 4.8399999999999999 110.462 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -79.43 164.2 24.04 Favored 'Trans proline' 0 C--O 1.234 0.276 0 C-N-CA 122.479 2.119 . . . . 4.7199999999999998 111.638 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 14.5 ttt85 -64.91 -29.21 70.14 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.337 -0.392 . . . . 4.4400000000000004 110.809 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -58.51 -44.12 89.38 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.819 -0.628 . . . . 4.6900000000000004 110.978 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -66.34 -38.48 87.74 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.656 -0.702 . . . . 3.2599999999999998 110.476 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 67.9 t -64.01 -50.98 74.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.636 -0.711 . . . . 2.1600000000000001 110.985 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 86.2 t -56.99 -51.1 73.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 112.219 0.451 . . . . 2.8900000000000001 112.219 -179.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 78.9 mttt -64.68 -44.68 89.57 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 112.254 0.465 . . . . 5.5 112.254 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -65.09 -38.43 90.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.841 0.353 . . . . 2.96 110.587 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.71 -35.99 73.01 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.059 -0.519 . . . . 3.4500000000000002 110.476 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? -60.23 -38.16 82.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.062 -0.517 . . . . 5.8499999999999996 111.674 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -87.4 -7.43 57.72 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.962 0.727 . . . . 5.5300000000000002 112.962 -179.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 16.2 p -108.46 -30.56 8.22 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.214 0.45 . . . . 5.4199999999999999 112.214 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 70.09 63.56 0.23 Allowed 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 114.123 1.157 . . . . 6.6399999999999997 114.123 179.025 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 89.67 -26.78 8.79 Favored Glycine 0 C--N 1.32 -0.313 0 N-CA-C 115.569 0.988 . . . . 4.3300000000000001 115.569 176.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -80.05 80.3 6.48 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 118.197 0.998 . . . . 6.4000000000000004 110.361 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -59.78 -27.05 66.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.98 -1.009 . . . . 4.3300000000000001 112.125 -178.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -62.46 -41.73 98.97 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.238 -1.023 . . . . 6.9900000000000002 108.238 178.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 44.7 m-85 -76.98 -30.69 56.07 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.243 -0.89 . . . . 7.4800000000000004 109.319 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -62.95 -43.81 97.78 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.935 -0.575 . . . . 3.8399999999999999 109.715 178.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -63.89 -39.23 93.7 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.15 -0.685 . . . . 3.7999999999999998 109.15 178.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 50.9 m -62.95 -30.89 71.92 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.623 -0.717 . . . . 5.0499999999999998 110.373 178.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -81.18 -49.62 10.58 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 115.808 -0.633 . . . . 4.3600000000000003 111.77 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 4.4 pp -64.22 -33.72 76.44 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.728 0.64 . . . . 3.21 112.728 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 427' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -75.86 -1.4 25.11 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 113.878 1.066 . . . . 5.2699999999999996 113.878 -178.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -89.7 11.31 20.27 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.105 0.479 . . . . 5.7699999999999996 111.258 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 C--O 1.248 1.025 0 CA-C-N 116.054 -0.521 . . . . 5.1100000000000003 110.61 179.546 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ptt? . . . . . 0 N--CA 1.481 1.076 0 CA-C-O 120.618 0.246 . . . . 1.6499999999999999 110.664 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 75.3 mm-40 -99.28 134.4 42.19 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.763 0.316 . . . . 2.04 110.908 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 23.3 pt -127.53 155.8 38.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.315 -0.402 . . . . 1.48 110.087 178.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -116.9 124.56 49.75 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.404 -0.362 . . . . 2.1699999999999999 110.454 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.3 t -111.21 123.49 67.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 110.108 -0.33 . . . . 1.6499999999999999 110.108 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -104.31 139.95 38.56 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.446 -0.343 . . . . 3.5099999999999998 110.922 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.4 p -107.26 174.21 5.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.345 -0.388 . . . . 2.1699999999999999 110.79 179.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.2 mt -58.81 -33.55 70.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.86 -0.609 . . . . 3.0499999999999998 112.086 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.91 -3.2 47.08 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.039 0.385 . . . . 2.7000000000000002 112.039 -179.118 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.91 8.17 69.75 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.755 -0.736 . . . . 2.6400000000000001 112.252 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -79.66 121.96 25.94 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.72 -0.474 . . . . 2.5600000000000001 109.72 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.8 m -103.65 128.12 51.01 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.917 0.389 . . . . 2.4100000000000001 111.185 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 18.4 mt -115.17 143.41 25.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 109.685 -0.487 . . . . 1.8300000000000001 109.685 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.5 m -111.96 125.6 54.24 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.652 0.263 . . . . 2.1899999999999999 110.306 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.8 mp -127.01 142.57 51.52 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.277 -0.419 . . . . 1.3600000000000001 110.916 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -99.19 106.2 18.33 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 116.078 -0.51 . . . . 2.3999999999999999 109.967 179.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.0 m -134.16 164.08 35.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 109.307 -0.627 . . . . 1.25 109.307 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -104.92 155.34 37.72 Favored Pre-proline 0 C--N 1.32 -0.689 0 C-N-CA 121.106 -0.238 . . . . 1.8500000000000001 110.439 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_exo -58.12 -17.43 31.76 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.991 2.461 . . . . 1.78 113.008 -179.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.1 -1.75 58.24 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.514 -0.312 . . . . 2.1200000000000001 111.804 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -79.32 142.56 35.98 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.902 0.382 . . . . 1.25 111.032 -179.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.6 m -81.59 146.79 29.93 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.784 -0.644 . . . . 1.77 110.269 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 43.0 mm -53.07 -44.97 52.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 O-C-N 123.202 0.314 . . . . 1.0600000000000001 111.585 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -58.35 -41.22 84.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.481 -0.327 . . . . 2.2200000000000002 111.527 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -63.45 -36.42 83.7 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.992 0.425 . . . . 1.3300000000000001 110.383 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 58.1 t -67.1 -42.61 88.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.989 -0.55 . . . . 0.67000000000000004 109.572 178.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 27.3 mtmt -63.31 -37.38 87.04 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.207 -0.451 . . . . 1.6899999999999999 110.37 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.86 -37.38 84.31 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.097 -0.501 . . . . 1.0800000000000001 109.844 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -68.49 -34.21 75.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.793 -0.639 . . . . 1.48 110.143 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 70.9 mt -70.63 -32.85 50.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 108.97 -0.752 . . . . 1.3100000000000001 108.97 178.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -66.31 -32.89 74.57 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.484 -0.78 . . . . 2.0899999999999999 109.383 178.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -71.79 -42.92 66.52 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.456 -0.793 . . . . 2.0499999999999998 109.705 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -66.82 -59.66 3.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.675 -0.693 . . . . 2.5099999999999998 112.186 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -92.0 -65.27 1.02 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.197 -0.456 . . . . 2.1400000000000001 112.179 -178.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 133.54 0.72 4.0 Favored Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.323 -0.941 . . . . 2.0099999999999998 112.652 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 16.7 mt -67.83 125.1 90.91 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 110.144 -0.317 . . . . 1.8300000000000001 110.144 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -54.84 135.89 69.77 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.73 2.286 . . . . 2.04 111.423 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -51.54 -30.58 36.29 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 123.271 2.647 . . . . 1.52 113.438 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -70.16 -29.69 66.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.162 0.506 . . . . 2.9500000000000002 111.584 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -89.0 -4.46 58.42 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.342 -0.39 . . . . 2.73 110.289 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -92.85 111.82 23.56 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.797 -0.638 . . . . 1.4399999999999999 111.173 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -125.07 104.3 8.47 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 108.618 -0.882 . . . . 2.9399999999999999 108.618 178.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 82.8 mt -81.99 138.09 34.98 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.9 0.704 . . . . 1.02 112.9 -178.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 65.8 mt -124.09 134.96 65.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.265 -0.88 . . . . 2.1400000000000001 109.732 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -124.19 107.16 10.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.446 -0.343 . . . . 1.71 110.274 179.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.33 35.1 23.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.882 -0.599 . . . . 2.1000000000000001 112.108 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.71 -13.48 67.38 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 120.909 -0.662 . . . . 1.8400000000000001 112.924 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.3 mttt -90.44 142.12 28.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.657 0.228 . . . . 3.4300000000000002 110.807 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -83.61 135.76 34.49 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 110.025 -0.361 . . . . 2.7200000000000002 110.025 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 40.7 mt -97.58 135.85 38.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.717 0.294 . . . . 1.1699999999999999 110.943 -179.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -96.51 138.48 34.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.007 0.432 . . . . 2.6499999999999999 111.078 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.25 -26.49 66.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.63 -0.713 . . . . 1.8300000000000001 112.527 -179.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -87.75 11.21 67.2 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.736 -0.745 . . . . 1.8200000000000001 114.043 -178.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 41.9 mmt-85 -117.79 164.07 15.56 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 117.26 0.53 . . . . 2.9300000000000002 111.11 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 61.1 p -102.05 171.83 7.27 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.175 -0.466 . . . . 1.71 110.202 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 84.0 mt -63.95 -33.72 76.36 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.105 0.479 . . . . 1.49 110.528 179.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 67.4 m -70.03 -23.94 63.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.921 -0.581 . . . . 2.1000000000000001 111.332 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -67.25 -20.21 65.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.397 -0.365 . . . . 2.0299999999999998 111.758 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -114.66 12.57 17.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.105 -0.498 . . . . 1.76 110.735 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.0 m-20 58.49 37.86 25.56 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.667 -0.697 . . . . 3.3700000000000001 111.625 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 86.9 mt -82.76 120.5 34.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.123 -0.49 . . . . 1.6499999999999999 110.112 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -106.33 -167.69 1.33 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.943 -0.571 . . . . 2.79 109.975 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.0 pttp -76.45 150.79 36.66 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 121.116 -0.233 . . . . 3.52 110.629 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 70.99 14.16 6.87 Favored 'General case' 0 C--O 1.235 0.29 0 O-C-N 123.654 0.597 . . . . 3.1200000000000001 112.155 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 35.5 m -79.0 149.66 32.16 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.301 -0.409 . . . . 1.8999999999999999 109.976 178.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -105.04 124.69 49.97 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.117 -0.492 . . . . 2.1600000000000001 111.059 -179.24 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.0 mp -110.8 138.5 47.12 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.993 -0.743 . . . . 1.4199999999999999 108.993 179.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 65.3 m80 -103.31 136.96 42.1 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.711 0.291 . . . . 3.1499999999999999 111.587 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 48.5 tp -123.59 102.3 7.78 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.993 -0.548 . . . . 1.54 109.96 179.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 16.5 t -92.21 135.65 26.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.041 -0.527 . . . . 1.79 109.792 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 65.6 mt -83.22 124.62 30.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.374 -0.375 . . . . 2.4300000000000002 111.452 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 38.1 ttt180 -118.67 99.11 6.58 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.891 -0.595 . . . . 3.5 110.836 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 89.0 mt -72.42 167.44 20.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.025 -0.534 . . . . 2.9900000000000002 110.457 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.323 -0.57 0 CA-C-O 120.859 0.361 . . . . 3.9199999999999999 111.204 -179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 . . . . . 0 N--CA 1.452 -0.349 0 N-CA-C 109.931 -0.396 . . . . 2.5499999999999998 109.931 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo -64.91 132.42 32.3 Favored 'Trans proline' 0 C--O 1.236 0.404 0 C-N-CA 122.667 2.244 . . . . 3.77 111.606 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -51.77 -45.26 63.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.734 -0.666 . . . . 5.3600000000000003 112.678 -178.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -54.5 -48.62 71.66 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.235 0.457 . . . . 6.8899999999999997 112.235 -179.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.54 -39.17 93.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.286 -0.416 . . . . 4.2000000000000002 110.898 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 395' ' ' ILE . . . . . . . . . . . . . 83.0 mt -62.73 -42.0 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.117 0 CA-C-N 116.19 -0.459 . . . . 3.7999999999999998 110.197 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -57.18 -43.71 82.9 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.186 -0.461 . . . . 6.5800000000000001 111.382 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 8.8 tp60 -65.8 -41.6 91.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.021 0.438 . . . . 7.46 110.808 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 92.8 mt -67.74 -34.94 77.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 4.3099999999999996 111.908 -179.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 31.5 mmt -67.27 -33.78 76.04 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.979 0.418 . . . . 5.7999999999999998 110.172 179.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -61.58 -27.2 68.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.527 -0.76 . . . . 7.71 111.697 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 30.9 mt -74.3 -6.45 48.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.12 -0.491 . . . . 5.6900000000000004 112.155 -179.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 85.53 46.36 5.51 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.609 -0.805 . . . . 5.8700000000000001 112.384 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -125.64 156.98 70.03 Favored Pre-proline 0 C--N 1.329 -0.285 0 C-N-CA 122.205 0.202 . . . . 4.8399999999999999 110.577 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -84.65 146.31 10.63 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.864 2.376 . . . . 4.7199999999999998 111.084 178.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 37.4 ttt180 -63.58 -32.24 73.64 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.784 0.29 . . . . 4.4400000000000004 111.784 -179.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -57.24 -40.07 76.85 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.154 0.502 . . . . 4.6900000000000004 110.719 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -69.79 -36.69 75.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.759 -0.655 . . . . 3.2599999999999998 109.931 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 49.7 t -63.24 -44.11 99.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.655 -0.702 . . . . 2.1600000000000001 110.272 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 74.1 t -56.52 -49.09 79.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.002 -0.544 . . . . 2.8900000000000001 109.877 179.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 51.4 mttp -63.82 -47.99 78.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.789 -0.641 . . . . 5.5 110.822 179.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -57.32 -51.04 71.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.807 -0.633 . . . . 2.96 112.563 -178.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 5.2 mp -68.78 -31.33 70.28 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.459 0.541 . . . . 3.4500000000000002 112.459 -179.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 8.8 mmtt -69.29 -41.56 76.66 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.083 0.401 . . . . 5.8499999999999996 112.083 -179.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -81.15 -8.57 59.79 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.7 0.63 . . . . 5.5300000000000002 112.7 -179.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 40.9 p -113.3 -4.83 13.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.792 0.329 . . . . 5.4199999999999999 110.961 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 56.3 m-20 63.59 58.25 1.34 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.756 -0.656 . . . . 6.6399999999999997 111.933 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 69.69 8.25 59.98 Favored Glycine 0 C--O 1.229 -0.178 0 CA-C-N 115.616 -0.72 . . . . 4.3300000000000001 114.089 178.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 -76.99 82.98 3.51 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 122.324 -0.515 . . . . 6.4000000000000004 109.734 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -48.16 -47.8 34.77 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 113.61 0.967 . . . . 4.3300000000000001 113.61 -178.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 4.1 pm0 -65.48 -43.36 90.48 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.813 0.34 . . . . 6.9900000000000002 111.889 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -69.23 -35.47 76.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.148 0.499 . . . . 7.4800000000000004 110.0 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -65.51 -37.51 87.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.47 -0.786 . . . . 3.8399999999999999 110.397 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -60.2 -43.36 95.98 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.052 0.454 . . . . 3.7999999999999998 109.991 179.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 65.8 m -74.85 -38.59 61.95 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.958 -0.565 . . . . 5.0499999999999998 111.514 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.5 -46.23 80.51 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.584 -0.28 . . . . 4.3600000000000003 111.529 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.58 -33.22 72.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.351 -0.386 . . . . 3.21 111.249 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 427' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.93 -0.94 10.34 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.332 0.493 . . . . 5.2699999999999996 112.332 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -70.29 -6.02 31.98 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.089 0.471 . . . . 5.7699999999999996 110.996 178.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 30.0 m . . . . . 0 C--O 1.246 0.916 0 CA-C-O 118.692 -0.671 . . . . 5.1100000000000003 109.871 179.036 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 ptt? . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 110.048 -0.352 . . . . 1.6499999999999999 110.048 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 75.2 mm-40 -103.84 133.47 48.76 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.616 0.246 . . . . 2.04 110.986 -179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 23.5 pt -129.3 169.34 20.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.31 -0.405 . . . . 1.48 110.04 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -125.45 135.15 52.04 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.423 -0.353 . . . . 2.1699999999999999 110.23 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.8 t -118.18 120.58 64.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.555 -0.293 . . . . 1.6499999999999999 110.348 179.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.0 mtmt -96.94 128.6 44.06 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.25 0.547 . . . . 3.5099999999999998 111.48 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.06 160.07 14.55 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.655 -0.702 . . . . 2.1699999999999999 110.126 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.16 -28.16 67.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.78 0.324 . . . . 3.0499999999999998 111.447 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.26 29.84 0.22 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.384 -0.371 . . . . 2.7000000000000002 111.742 -179.597 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 51.66 46.49 53.78 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 121.416 -0.421 . . . . 2.6400000000000001 112.75 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -126.77 153.67 45.26 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 110.128 -0.323 . . . . 2.5600000000000001 110.128 -179.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.1 m -128.17 121.42 29.44 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.014 0.435 . . . . 2.4100000000000001 110.725 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 5.4 mt -106.02 140.06 25.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.03 -0.532 . . . . 1.8300000000000001 110.544 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.73 135.3 35.17 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.124 -0.324 . . . . 2.1899999999999999 110.124 179.37 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 34.9 mt -135.3 137.46 42.48 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.946 0.403 . . . . 1.3600000000000001 111.522 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -105.66 106.77 17.43 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.691 -0.686 . . . . 2.3999999999999999 109.229 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 4.2 m -138.98 178.19 4.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.176 -0.466 . . . . 1.25 110.713 -179.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -127.13 155.75 75.58 Favored Pre-proline 0 C--N 1.32 -0.682 0 N-CA-C 109.442 -0.577 . . . . 1.8500000000000001 109.442 179.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -52.34 -29.95 40.93 Favored 'Trans proline' 0 CA--C 1.532 0.378 0 C-N-CA 122.745 2.297 . . . . 1.78 113.017 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.23 -4.37 50.33 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.399 0.518 . . . . 2.1200000000000001 112.399 -179.524 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.87 135.64 40.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.743 0.306 . . . . 1.25 110.517 -179.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.91 145.21 31.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.065 -0.516 . . . . 1.77 110.261 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 46.6 mm -55.09 -43.76 71.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 O-C-N 123.111 0.257 . . . . 1.0600000000000001 111.225 -179.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -58.63 -38.93 79.13 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.318 -0.401 . . . . 2.2200000000000002 110.826 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -69.38 -37.34 77.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.244 -0.434 . . . . 1.3300000000000001 109.939 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 97.3 t -62.23 -42.71 96.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.966 -0.561 . . . . 0.67000000000000004 109.826 179.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.3 mtmt -62.81 -34.78 78.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.033 -0.53 . . . . 1.6899999999999999 110.815 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.56 -38.76 92.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.037 0.446 . . . . 1.0800000000000001 109.81 178.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 48.7 mttt -67.57 -32.5 73.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.864 -0.607 . . . . 1.48 110.069 179.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 69.4 mt -69.09 -35.6 69.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.091 -0.504 . . . . 1.3100000000000001 109.75 179.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -65.7 -31.98 73.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.176 -0.465 . . . . 2.0899999999999999 110.126 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -74.79 -2.5 26.89 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.848 -0.615 . . . . 2.0499999999999998 110.82 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -121.96 -45.15 2.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.305 -0.407 . . . . 2.5099999999999998 112.014 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -92.63 -21.84 19.81 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.271 0.471 . . . . 2.1400000000000001 112.271 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.34 19.39 78.34 Favored Glycine 0 CA--C 1.518 0.256 0 C-N-CA 120.57 -0.824 . . . . 2.0099999999999998 112.115 -179.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 44.6 mt -104.49 125.73 33.31 Favored Pre-proline 0 C--N 1.327 -0.404 0 N-CA-C 110.337 -0.246 . . . . 1.8300000000000001 110.337 -179.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -57.8 140.96 95.44 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.835 2.357 . . . . 2.04 112.044 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -60.11 -18.66 52.44 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 123.126 2.551 . . . . 1.52 112.253 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -63.61 -31.71 72.96 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.835 -0.621 . . . . 2.9500000000000002 110.843 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -102.61 -0.59 31.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.074 -0.512 . . . . 2.73 110.779 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 56.3 mt-30 -87.21 120.49 28.55 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.084 -0.507 . . . . 1.4399999999999999 111.818 -178.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 40.8 mtt180 -126.29 124.09 39.55 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.025 -0.731 . . . . 2.9399999999999999 109.025 178.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 85.1 mt -108.92 129.06 55.42 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.898 0.38 . . . . 1.02 111.022 -179.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -120.67 144.73 28.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 116.062 -0.517 . . . . 2.1400000000000001 110.366 179.202 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -129.64 101.98 6.15 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.887 -0.783 . . . . 1.71 108.887 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.69 34.31 22.09 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.993 -0.549 . . . . 2.1000000000000001 110.921 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.74 -9.72 76.85 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 121.038 -0.601 . . . . 1.8400000000000001 113.358 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -88.72 134.19 33.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.892 0.346 . . . . 3.4300000000000002 111.522 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -74.82 120.1 19.9 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.512 -0.767 . . . . 2.7200000000000002 111.232 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.1 mt -86.33 110.58 19.76 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.918 -0.401 . . . . 1.1699999999999999 109.918 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -74.67 135.74 41.91 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.219 -0.446 . . . . 2.6499999999999999 111.308 -179.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -59.93 -31.48 69.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.673 -0.694 . . . . 1.8300000000000001 111.624 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.93 7.43 62.99 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.924 -0.58 . . . . 1.8200000000000001 113.4 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 17.7 mmt-85 -115.03 167.74 10.54 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 122.577 -0.366 . . . . 2.9300000000000002 110.257 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 42.3 p -110.12 176.82 4.91 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.768 0.318 . . . . 1.71 110.615 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 80.4 mt -65.62 -36.64 84.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.282 -0.417 . . . . 1.49 111.785 -179.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.51 -25.09 66.52 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 111.912 0.338 . . . . 2.1000000000000001 111.912 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -62.46 -34.8 77.54 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.887 0.375 . . . . 2.0299999999999998 111.126 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -103.87 15.08 29.49 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.006 -0.543 . . . . 1.76 111.518 -179.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 59.45 40.07 21.17 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.436 0.636 . . . . 3.3700000000000001 111.689 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 92.8 mt -83.11 121.66 36.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.929 -0.578 . . . . 1.6499999999999999 109.883 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -114.94 -166.23 1.09 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.852 -0.613 . . . . 2.79 110.558 -179.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 42.6 pttt -70.09 148.3 48.93 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.493 -0.321 . . . . 3.52 111.515 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 70.96 0.13 3.27 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 113.149 0.796 . . . . 3.1200000000000001 113.149 179.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 16.7 m -65.31 140.8 58.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.837 0.351 . . . . 1.8999999999999999 110.393 179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.5 m -104.33 126.92 51.85 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.022 0.439 . . . . 2.1600000000000001 111.501 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.4 mp -108.0 146.35 32.62 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.801 -0.814 . . . . 1.4199999999999999 108.801 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 44.4 m80 -105.43 134.93 47.74 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.701 0.286 . . . . 3.1499999999999999 110.845 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 36.4 tp -119.76 115.72 24.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.131 -0.486 . . . . 1.54 111.394 -179.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 9.1 t -120.18 129.27 75.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.947 -0.569 . . . . 1.79 109.623 178.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 58.5 mt -71.5 126.48 29.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.101 -0.499 . . . . 2.4300000000000002 110.916 -179.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.5 92.63 7.65 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.886 -0.597 . . . . 3.5 110.508 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 84.1 mt -77.72 128.77 34.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.276 -0.42 . . . . 2.9900000000000002 110.799 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.4 mmm180 . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 116.2 -0.455 . . . . 3.9199999999999999 110.401 179.467 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.278 0 CA-C-O 120.642 0.258 . . . . 2.5499999999999998 110.824 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -65.35 146.92 86.94 Favored 'Trans proline' 0 C--O 1.234 0.313 0 C-N-CA 122.924 2.416 . . . . 3.77 112.13 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.23 -56.55 13.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.488 -0.778 . . . . 5.3600000000000003 112.917 -178.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -61.51 -43.79 98.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.268 -0.424 . . . . 6.8899999999999997 111.682 -179.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 22.3 m -55.61 -48.6 74.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.976 -0.556 . . . . 4.2000000000000002 111.439 -179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 395' ' ' ILE . . . . . . . . . . . . . 84.0 mt -61.62 -50.05 81.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.856 0.36 . . . . 3.7999999999999998 110.266 179.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -56.6 -45.43 81.42 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.981 0.734 . . . . 6.5800000000000001 112.981 -178.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.58 -33.2 75.36 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.871 -0.331 . . . . 7.46 111.519 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 84.6 mt -78.74 -25.25 44.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.849 0.356 . . . . 4.3099999999999996 111.268 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 31.7 mmt -73.92 -24.87 59.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.072 0.463 . . . . 5.7999999999999998 109.891 179.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -61.27 -30.19 70.31 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.516 -0.765 . . . . 7.71 111.366 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 9.8 mt -65.4 -15.35 62.5 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.955 -0.566 . . . . 5.6900000000000004 111.443 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 98.0 39.25 3.86 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.735 -0.745 . . . . 5.8700000000000001 112.082 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -120.12 154.84 56.02 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-O 120.413 0.149 . . . . 4.8399999999999999 110.714 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -78.79 158.19 27.87 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.526 2.151 . . . . 4.7199999999999998 112.386 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 11.4 ttt85 -63.8 -32.01 73.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.834 -0.621 . . . . 4.4400000000000004 110.838 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -61.46 -40.3 94.03 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.956 0.408 . . . . 4.6900000000000004 110.54 179.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -65.77 -39.01 90.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.77 -0.65 . . . . 3.2599999999999998 111.37 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 1.4 p -66.44 -35.03 73.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 C-N-CA 120.896 -0.322 . . . . 2.1600000000000001 111.367 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 84.8 t -67.14 -44.62 87.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.99 0.424 . . . . 2.8900000000000001 109.892 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -62.96 -47.06 84.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.812 -0.631 . . . . 5.5 110.587 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -63.94 -45.83 87.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.894 -0.594 . . . . 2.96 110.859 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.77 -51.44 69.73 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.432 0.531 . . . . 3.4500000000000002 112.432 -179.262 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 5.9 mtpm? -60.51 -31.47 70.54 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.459 0.541 . . . . 5.8499999999999996 112.459 -179.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -87.86 -18.85 28.32 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 113.362 0.875 . . . . 5.5300000000000002 113.362 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 35.0 p -107.62 3.99 25.4 Favored 'General case' 0 C--O 1.236 0.36 0 O-C-N 121.858 -0.526 . . . . 5.4199999999999999 111.77 -178.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 67.71 50.83 0.85 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.869 -0.605 . . . . 6.6399999999999997 111.202 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 66.15 -27.33 0.16 Allowed Glycine 0 CA--C 1.528 0.848 0 N-CA-C 117.373 1.709 . . . . 4.3300000000000001 117.373 176.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -58.9 113.98 2.33 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 118.588 1.194 . . . . 6.4000000000000004 113.199 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -61.02 -26.01 67.3 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.33 -0.85 . . . . 4.3300000000000001 113.252 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -59.24 -56.35 23.29 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.585 0.707 . . . . 6.9900000000000002 110.667 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -74.95 -29.79 61.03 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.769 -0.65 . . . . 7.4800000000000004 110.43 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -60.47 -48.53 81.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.702 -0.681 . . . . 3.8399999999999999 110.193 179.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -62.81 -38.78 92.06 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.873 -0.603 . . . . 3.7999999999999998 110.006 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 69.0 m -64.28 -31.53 72.77 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.038 -0.528 . . . . 5.0499999999999998 110.731 178.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -81.9 -48.94 10.91 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 112.903 0.705 . . . . 4.3600000000000003 112.903 -179.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.5 pp -64.02 -33.21 75.22 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.768 0.655 . . . . 3.21 112.768 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 427' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -69.3 -1.24 7.64 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 113.893 1.071 . . . . 5.2699999999999996 113.893 -179.052 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -113.89 23.45 13.0 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.499 0.555 . . . . 5.7699999999999996 112.499 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 13.3 m . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.584 -0.722 . . . . 5.1100000000000003 110.302 179.526 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ptt? . . . . . 0 N--CA 1.482 1.152 0 N-CA-C 110.179 -0.304 . . . . 1.6499999999999999 110.179 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 46.0 mm-40 -107.84 142.62 37.63 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.583 0.23 . . . . 2.04 110.796 -179.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 18.1 pt -130.89 153.75 39.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.399 -0.364 . . . . 1.48 110.258 179.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -105.16 119.54 39.3 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.544 -0.298 . . . . 2.1699999999999999 110.597 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.3 t -103.16 119.35 51.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 110.027 -0.36 . . . . 1.6499999999999999 110.027 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -103.12 131.74 49.91 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.266 -0.424 . . . . 3.5099999999999998 110.983 -179.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.71 161.5 13.57 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.139 -0.482 . . . . 2.1699999999999999 109.877 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 78.0 mt -59.39 -23.6 62.74 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.258 0.466 . . . . 3.0499999999999998 112.258 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -79.91 -8.08 59.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.98 0.419 . . . . 2.7000000000000002 111.699 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.12 3.01 57.97 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.765 -0.731 . . . . 2.6400000000000001 111.968 -179.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -75.44 146.47 40.69 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.457 -0.571 . . . . 2.5600000000000001 109.457 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.2 m -139.26 119.71 13.92 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.726 0.298 . . . . 2.4100000000000001 110.897 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 24.4 pt -119.33 148.83 22.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.537 -0.301 . . . . 1.8300000000000001 110.818 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 6.6 m -103.91 111.64 24.26 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.918 0.389 . . . . 2.1899999999999999 110.391 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.5 mt -104.47 152.39 22.4 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.22 -0.445 . . . . 1.3600000000000001 111.126 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -98.96 121.23 40.65 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.882 -0.599 . . . . 2.3999999999999999 110.739 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 5.8 m -138.5 163.58 28.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 116.158 -0.474 . . . . 1.25 110.684 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -117.94 158.3 46.25 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 116.034 -0.53 . . . . 1.8500000000000001 109.778 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -58.29 -23.65 63.75 Favored 'Trans proline' 0 N--CA 1.475 0.405 0 C-N-CA 122.607 2.205 . . . . 1.78 112.388 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -92.71 3.76 55.01 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.171 -0.468 . . . . 2.1200000000000001 111.599 -179.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -77.45 130.46 37.05 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 120.833 0.349 . . . . 1.25 110.916 -179.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.22 155.23 27.46 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.131 -0.692 . . . . 1.77 109.131 178.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 43.7 mm -58.59 -38.18 69.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 120.518 0.199 . . . . 1.0600000000000001 111.347 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -60.62 -34.91 74.95 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.114 0.483 . . . . 2.2200000000000002 110.3 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -65.0 -36.14 83.45 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 115.98 -0.555 . . . . 1.3300000000000001 110.377 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 22.0 t -66.04 -38.63 82.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.076 -0.511 . . . . 0.67000000000000004 109.648 179.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.5 mmmm -61.0 -40.9 95.29 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.723 -0.671 . . . . 1.6899999999999999 109.948 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.67 -36.08 82.63 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.638 -0.71 . . . . 1.0800000000000001 110.588 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 87.4 mttt -68.52 -39.93 81.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.423 -0.353 . . . . 1.48 110.47 179.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 81.7 mt -66.8 -36.32 76.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 109.41 -0.589 . . . . 1.3100000000000001 109.41 178.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -66.82 -33.48 75.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.76 -0.654 . . . . 2.0899999999999999 110.038 179.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -69.41 -34.56 74.66 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.699 -0.682 . . . . 2.0499999999999998 110.821 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -84.88 -61.46 1.77 Allowed 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.581 0.585 . . . . 2.5099999999999998 112.581 -179.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -80.73 -45.94 16.29 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 113.089 0.774 . . . . 2.1400000000000001 113.089 -177.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 99.33 25.44 9.42 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.517 -0.849 . . . . 2.0099999999999998 111.576 -178.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 71.9 mt -98.62 127.66 35.1 Favored Pre-proline 0 C--N 1.326 -0.451 0 N-CA-C 109.617 -0.512 . . . . 1.8300000000000001 109.617 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -50.97 133.41 40.42 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.991 2.461 . . . . 2.04 112.104 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.53 -19.68 53.42 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 123.338 2.692 . . . . 1.52 112.625 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -21.14 58.52 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.349 -0.387 . . . . 2.9500000000000002 110.92 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -98.14 -13.9 20.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.139 0.495 . . . . 2.73 110.373 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -78.84 122.83 26.57 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.809 -0.632 . . . . 1.4399999999999999 111.951 -179.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 14.1 mmt85 -121.44 107.61 12.67 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.189 -0.671 . . . . 2.9399999999999999 109.189 177.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 69.7 mt -91.87 125.47 36.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.084 -0.507 . . . . 1.02 112.309 -178.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.9 mt -117.23 146.18 22.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.639 -0.709 . . . . 2.1400000000000001 109.816 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -132.8 93.16 3.16 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.39 -0.368 . . . . 1.71 110.36 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 56.29 50.46 13.27 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 113.002 0.741 . . . . 2.1000000000000001 113.002 179.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.63 -38.69 3.01 Favored Glycine 0 CA--C 1.517 0.172 0 C-N-CA 120.721 -0.752 . . . . 1.8400000000000001 113.525 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -85.8 153.27 22.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.67 0.235 . . . . 3.4300000000000002 110.513 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -97.77 145.57 26.24 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.998 0.428 . . . . 2.7200000000000002 111.031 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 73.0 mt -89.71 122.97 33.32 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.652 -0.703 . . . . 1.1699999999999999 110.441 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -88.83 130.14 35.44 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.094 -0.503 . . . . 2.6499999999999999 110.225 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -54.69 -28.31 46.75 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.045 0.387 . . . . 1.8300000000000001 112.045 -179.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -85.38 10.86 62.65 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.918 -0.658 . . . . 1.8200000000000001 113.231 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 81.6 mmt-85 -115.75 169.92 8.84 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 117.011 0.405 . . . . 2.9300000000000002 110.866 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 25.9 p -111.61 166.16 11.39 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.773 -0.649 . . . . 1.71 109.638 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 83.7 mt -64.16 -28.45 69.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.067 0.461 . . . . 1.49 110.942 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.8 m -73.08 -19.59 61.13 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.866 -0.606 . . . . 2.1000000000000001 111.698 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -66.7 -34.22 77.36 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.103 0.478 . . . . 2.0299999999999998 110.65 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -101.69 8.95 41.41 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.807 -0.633 . . . . 1.76 109.934 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 53.37 49.71 19.12 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.653 -0.703 . . . . 3.3700000000000001 110.512 -179.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 79.8 mt -81.67 106.88 13.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.47 -0.786 . . . . 1.6499999999999999 110.003 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -84.76 177.98 7.81 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.718 -0.674 . . . . 2.79 110.399 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.87 148.66 51.64 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.199 -0.455 . . . . 3.52 110.173 179.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 74.17 8.69 4.63 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 113.065 0.765 . . . . 3.1200000000000001 113.065 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.6 m -70.94 150.35 45.8 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 122.13 -0.357 . . . . 1.8999999999999999 110.958 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.6 m -104.14 127.71 51.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.047 0.451 . . . . 2.1600000000000001 111.109 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.8 mp -111.08 145.75 38.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.669 -0.696 . . . . 1.4199999999999999 109.314 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 65.3 m80 -102.74 129.7 49.45 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.749 0.309 . . . . 3.1499999999999999 111.631 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 51.6 tp -110.12 105.68 14.86 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.945 -0.571 . . . . 1.54 110.483 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 62.6 t -98.01 137.0 26.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 115.884 -0.598 . . . . 1.79 110.424 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 66.9 mt -86.62 107.95 18.4 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.047 -0.524 . . . . 2.4300000000000002 109.625 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -104.13 95.3 5.88 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.241 -0.436 . . . . 3.5 111.037 -179.404 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 42.7 mt -80.56 161.7 24.65 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.045 -0.525 . . . . 2.9900000000000002 109.625 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.1 mmt180 . . . . . 0 C--N 1.324 -0.509 0 CA-C-O 120.856 0.36 . . . . 3.9199999999999999 110.994 -179.794 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.455 -0.205 0 CA-C-O 120.67 0.272 . . . . 2.5499999999999998 110.721 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -60.16 149.98 81.98 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 122.87 2.38 . . . . 3.77 112.421 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -53.51 -46.45 70.09 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.651 -0.704 . . . . 5.3600000000000003 112.719 -179.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -54.88 -51.29 66.43 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.828 0.347 . . . . 6.8899999999999997 111.499 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -39.72 86.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.948 -0.569 . . . . 4.2000000000000002 111.736 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 395' ' ' ILE . . . . . . . . . . . . . 73.3 mt -61.71 -51.36 73.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-O 120.884 0.373 . . . . 3.7999999999999998 109.996 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -55.12 -33.68 63.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.788 -0.642 . . . . 6.5800000000000001 112.57 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 -69.32 -53.57 18.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.941 0.4 . . . . 7.46 110.822 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 88.8 mt -67.57 -29.45 68.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.023 -0.535 . . . . 4.3099999999999996 112.3 -178.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 28.6 mmt -68.96 -27.57 65.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.62 0.248 . . . . 5.7999999999999998 111.45 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -71.45 -19.57 62.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.044 -0.525 . . . . 7.71 111.537 -179.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 47.5 mt -69.62 -26.53 64.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.231 -0.441 . . . . 5.6900000000000004 110.966 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 112.83 6.75 22.67 Favored Glycine 0 N--CA 1.453 -0.172 0 C-N-CA 120.685 -0.769 . . . . 5.8700000000000001 112.567 -179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -89.64 150.14 43.62 Favored Pre-proline 0 C--N 1.328 -0.354 0 N-CA-C 110.393 -0.225 . . . . 4.8399999999999999 110.393 179.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -72.65 156.47 53.52 Favored 'Trans proline' 0 C--O 1.236 0.393 0 C-N-CA 122.457 2.105 . . . . 4.7199999999999998 111.347 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 36.3 ttt-85 -60.65 -30.7 70.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.51 -0.314 . . . . 4.4400000000000004 111.498 -179.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -58.89 -38.69 79.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.332 -0.395 . . . . 4.6900000000000004 110.844 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -62.37 -38.56 90.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.968 -0.56 . . . . 3.2599999999999998 110.041 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 2.6 t -65.33 -43.53 94.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.898 -0.592 . . . . 2.1600000000000001 110.647 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 48.7 t -57.06 -49.03 80.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.248 -0.433 . . . . 2.8900000000000001 110.45 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 75.6 mttt -68.08 -48.0 66.72 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.94 -0.573 . . . . 5.5 111.717 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -60.75 -50.71 72.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.321 0.489 . . . . 2.96 112.321 -179.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.17 -30.83 71.78 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.466 0.543 . . . . 3.4500000000000002 112.466 -178.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -68.84 -37.97 79.5 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 111.83 0.308 . . . . 5.8499999999999996 111.83 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 29.2 pt20 -87.68 -8.13 56.52 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 113.018 0.748 . . . . 5.5300000000000002 113.018 -179.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 25.1 p -109.22 -19.39 13.34 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 120.934 0.397 . . . . 5.4199999999999999 111.574 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 68.3 62.1 0.38 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.19 0.811 . . . . 6.6399999999999997 113.19 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 79.44 -23.34 3.47 Favored Glycine 0 CA--C 1.521 0.465 0 N-CA-C 115.547 0.979 . . . . 4.3300000000000001 115.547 177.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -65.94 103.33 0.91 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 117.585 0.692 . . . . 6.4000000000000004 110.546 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -67.13 -38.72 86.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.914 -0.585 . . . . 4.3300000000000001 111.614 -179.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -66.24 -38.74 88.6 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-O 121.299 0.571 . . . . 6.9900000000000002 110.018 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -72.92 -36.01 67.17 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.876 -0.787 . . . . 7.4800000000000004 108.876 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -62.69 -43.25 99.29 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.734 -0.666 . . . . 3.8399999999999999 110.161 178.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -61.16 -38.18 85.54 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.215 0.531 . . . . 3.7999999999999998 110.151 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 17.7 m -72.35 -34.85 68.31 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.53 -0.759 . . . . 5.0499999999999998 110.45 178.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -71.53 -46.12 60.48 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.993 -0.548 . . . . 4.3600000000000003 111.715 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.7 pp -65.41 -34.08 77.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.107 0.479 . . . . 3.21 111.136 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 427' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -77.16 2.88 14.03 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 113.405 0.891 . . . . 5.2699999999999996 113.405 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -57.66 -23.42 51.24 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 120.799 0.333 . . . . 5.7699999999999996 110.76 178.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.667 -0.682 . . . . 5.1100000000000003 110.276 179.699 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 ptt? . . . . . 0 N--CA 1.483 1.209 0 CA-C-O 120.569 0.223 . . . . 1.6499999999999999 110.694 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 71.0 mm-40 -112.48 145.31 40.44 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.901 0.381 . . . . 2.04 111.953 -179.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 20.2 pt -130.12 155.04 41.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.993 -0.549 . . . . 1.48 109.54 178.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -111.14 115.14 28.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.736 0.303 . . . . 2.1699999999999999 110.899 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.6 t -99.97 119.79 48.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.389 -0.368 . . . . 1.6499999999999999 110.615 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -94.57 128.98 41.56 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.299 -0.41 . . . . 3.5099999999999998 110.566 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.22 163.65 12.31 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.206 -0.452 . . . . 2.1699999999999999 110.088 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 27.9 mt -62.85 -20.8 65.44 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.937 0.399 . . . . 3.0499999999999998 111.72 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.3 p -81.84 -3.76 54.83 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.245 -0.434 . . . . 2.7000000000000002 110.846 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.78 -6.87 77.19 Favored Glycine 0 C--N 1.335 0.492 0 N-CA-C 111.369 -0.692 . . . . 2.6400000000000001 111.369 -179.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -68.32 149.67 49.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.35 -0.425 . . . . 2.5600000000000001 110.811 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.3 m -126.19 128.37 47.14 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.366 -0.605 . . . . 2.4100000000000001 109.366 178.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.2 mt -113.35 129.45 69.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.651 -0.25 . . . . 1.8300000000000001 111.461 -178.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.96 110.03 22.31 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.995 -0.743 . . . . 2.1899999999999999 108.995 178.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.7 mt -114.77 142.05 47.05 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.513 0.56 . . . . 1.3600000000000001 112.513 -178.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -84.44 120.24 26.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.423 -0.808 . . . . 2.3999999999999999 109.401 179.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 15.3 m -142.34 178.8 2.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 116.146 -0.479 . . . . 1.25 109.998 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -145.71 163.26 32.3 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 109.019 -0.734 . . . . 1.8500000000000001 109.019 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -55.82 -27.04 60.41 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.418 2.078 . . . . 1.78 112.758 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.07 11.44 18.44 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.301 -0.409 . . . . 2.1200000000000001 111.78 -179.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -86.66 134.17 33.63 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.031 -0.359 . . . . 1.25 110.031 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -92.36 148.69 21.92 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.38 -0.373 . . . . 1.77 110.698 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 44.8 mm -55.36 -41.1 60.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.376 -0.374 . . . . 1.0600000000000001 111.792 -179.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -65.17 -30.04 70.92 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.881 0.372 . . . . 2.2200000000000002 111.266 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -76.2 -37.21 58.09 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.586 -0.524 . . . . 1.3300000000000001 109.586 179.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 66.8 t -64.76 -37.13 79.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.854 -0.612 . . . . 0.67000000000000004 109.922 178.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.503 ' HZ3' ' CG ' ' A' ' 52' ' ' ASP . 92.0 mttt -60.52 -37.1 80.07 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.79 -0.641 . . . . 1.6899999999999999 111.074 179.609 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.29 -36.66 84.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 1.0800000000000001 110.282 179.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 87.0 mttt -65.72 -38.23 88.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.835 -0.62 . . . . 1.48 110.265 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 47.3 mt -70.32 -30.95 45.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.176 -0.465 . . . . 1.3100000000000001 110.312 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -71.09 -34.54 71.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.96 0.409 . . . . 2.0899999999999999 110.205 179.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -72.59 -33.68 66.9 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.145 0.497 . . . . 2.0499999999999998 110.681 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -83.62 -63.11 1.41 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.026 -0.534 . . . . 2.5099999999999998 112.43 -179.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -79.7 -48.61 13.39 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.479 0.548 . . . . 2.1400000000000001 112.479 -178.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 115.8 -12.2 17.94 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.707 -0.759 . . . . 2.0099999999999998 111.727 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 13.0 mt -68.57 124.29 89.67 Favored Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 110.338 -0.245 . . . . 1.8300000000000001 110.338 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -63.12 143.62 90.65 Favored 'Trans proline' 0 C--O 1.233 0.274 0 C-N-CA 122.84 2.36 . . . . 2.04 111.457 179.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -56.7 -23.64 50.57 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.332 2.688 . . . . 1.52 112.297 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.96 -23.41 65.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.97 -0.559 . . . . 2.9500000000000002 110.612 179.55 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -112.06 9.37 20.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.955 -0.566 . . . . 2.73 110.543 -179.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -97.0 100.16 11.68 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.767 -0.651 . . . . 1.4399999999999999 111.244 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 52.4 mtp180 -104.46 103.89 13.66 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.05 -0.722 . . . . 2.9399999999999999 109.05 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.3 mp -104.51 144.1 32.14 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.885 0.698 . . . . 1.02 112.885 -178.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -135.44 151.37 30.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.36 -0.836 . . . . 2.1400000000000001 110.268 179.048 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -121.02 87.74 2.81 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.104 -0.702 . . . . 1.71 109.104 178.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 56.1 65.86 1.34 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.826 -0.625 . . . . 2.1000000000000001 111.946 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 76.13 -9.28 19.86 Favored Glycine 0 CA--C 1.521 0.467 0 CA-C-N 115.801 -0.636 . . . . 1.8400000000000001 114.301 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.3 mtmm -100.88 124.61 46.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 117.25 0.525 . . . . 3.4300000000000002 111.192 -179.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -75.43 134.55 40.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.25 -0.432 . . . . 2.7200000000000002 110.489 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 36.8 mt -93.07 125.56 37.72 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.295 -0.411 . . . . 1.1699999999999999 111.24 -179.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -89.11 132.16 34.93 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.81 -0.441 . . . . 2.6499999999999999 109.81 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.503 ' CG ' ' HZ3' ' A' ' 27' ' ' LYS . 24.0 m-20 -56.19 -30.66 62.57 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.974 0.731 . . . . 1.8300000000000001 112.974 -178.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -87.72 18.23 40.22 Favored Glycine 0 CA--C 1.519 0.286 0 C-N-CA 120.948 -0.644 . . . . 1.8200000000000001 113.356 -179.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 22.4 mmm-85 -120.28 163.61 17.55 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.966 0.383 . . . . 2.9300000000000002 111.099 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.42 169.19 8.68 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.674 -0.694 . . . . 1.71 110.211 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 72.8 mt -63.33 -33.84 76.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.824 0.345 . . . . 1.49 111.527 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.08 -19.1 65.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.188 -0.46 . . . . 2.1000000000000001 111.329 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -65.38 -31.15 72.11 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 116.233 -0.439 . . . . 2.0299999999999998 111.548 -179.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 -111.91 14.23 20.91 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.287 -0.415 . . . . 1.76 110.407 -179.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 48.8 t30 59.67 34.14 22.08 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.455 -0.793 . . . . 3.3700000000000001 111.289 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 72.7 mt -75.66 109.8 9.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.848 -0.615 . . . . 1.6499999999999999 109.725 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -106.14 -166.6 1.21 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.871 -0.604 . . . . 2.79 110.685 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 8.3 pttm -68.95 145.26 53.78 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.409 -0.359 . . . . 3.52 110.993 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 71.74 8.34 6.09 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.495 0.924 . . . . 3.1200000000000001 113.495 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.1 m -72.03 143.31 49.19 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.754 0.312 . . . . 1.8999999999999999 110.262 179.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.43 125.7 46.75 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.192 -0.458 . . . . 2.1600000000000001 111.21 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.0 mp -114.54 146.14 41.1 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.491 -0.929 . . . . 1.4199999999999999 108.491 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 63.8 m80 -109.63 137.63 47.17 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 120.726 0.298 . . . . 3.1499999999999999 111.56 -179.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 52.0 tp -118.35 116.48 26.83 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.934 -0.575 . . . . 1.54 111.128 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 22.9 t -98.71 129.28 49.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.691 -0.686 . . . . 1.79 109.648 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 58.3 mt -76.06 117.74 18.09 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.769 -0.65 . . . . 2.4300000000000002 111.106 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 60.3 ttt180 -93.27 103.15 15.42 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.832 -0.622 . . . . 3.5 110.815 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 34.9 mt -78.8 120.88 24.07 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.099 -0.501 . . . . 2.9900000000000002 110.71 179.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 . . . . . 0 C--N 1.325 -0.471 0 CA-C-N 116.255 -0.429 . . . . 3.9199999999999999 110.669 179.77 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 . . . . . 0 N--CA 1.452 -0.358 0 CA-C-O 120.6 0.238 . . . . 2.5499999999999998 110.439 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -70.04 130.87 19.71 Favored 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.792 2.328 . . . . 3.77 111.359 179.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -50.67 -49.22 57.72 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.886 0.699 . . . . 5.3600000000000003 112.886 -179.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -60.22 -42.15 94.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.437 -0.347 . . . . 6.8899999999999997 111.086 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 11.2 m -63.74 -43.4 96.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.037 -0.528 . . . . 4.2000000000000002 110.969 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 395' ' ' ILE . . . . . . . . . . . . . 84.8 mt -59.14 -49.27 83.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.493 -0.321 . . . . 3.7999999999999998 110.685 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -61.51 -42.95 99.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.007 -0.542 . . . . 6.5800000000000001 111.281 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -64.6 -44.67 89.87 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.777 0.322 . . . . 7.46 111.217 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 98.1 mt -66.59 -37.97 86.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 4.3099999999999996 111.717 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 39.0 mtp -67.51 -32.79 73.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.459 -0.337 . . . . 5.7999999999999998 111.397 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -65.66 -28.55 69.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.267 -0.424 . . . . 7.71 111.215 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 14.3 mt -64.97 -18.46 65.29 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.131 0.491 . . . . 5.6900000000000004 110.681 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 107.91 23.28 6.85 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.76 -0.655 . . . . 5.8700000000000001 111.524 -179.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -114.38 139.44 23.88 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-O 120.768 0.318 . . . . 4.8399999999999999 110.806 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -77.16 164.39 29.39 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.671 2.248 . . . . 4.7199999999999998 112.056 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 56.3 mtt180 -60.11 -28.06 67.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.835 -0.62 . . . . 4.4400000000000004 110.798 179.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -58.07 -44.65 87.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.712 -0.676 . . . . 4.6900000000000004 110.675 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -67.66 -36.3 80.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.635 -0.711 . . . . 3.2599999999999998 110.117 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 91.0 t -60.96 -53.27 51.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.659 -0.7 . . . . 2.1600000000000001 110.521 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 88.1 t -54.8 -49.51 68.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.136 -0.484 . . . . 2.8900000000000001 112.046 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -66.23 -49.51 66.98 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.747 0.647 . . . . 5.5 112.747 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -64.16 -48.5 75.76 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.374 0.509 . . . . 2.96 112.374 -178.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -62.72 -39.82 95.24 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.463 0.542 . . . . 3.4500000000000002 112.463 -178.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 13.4 mmmt -64.26 -42.29 96.53 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.147 0.425 . . . . 5.8499999999999996 112.147 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -77.87 -8.91 58.71 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.478 0.547 . . . . 5.5300000000000002 112.478 -179.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 25.3 p -113.3 8.23 17.99 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.754 0.311 . . . . 5.4199999999999999 111.63 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 61.33 39.78 15.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.071 -0.513 . . . . 6.6399999999999997 112.362 179.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 79.7 -15.68 13.56 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.715 -0.755 . . . . 4.3300000000000001 114.194 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -67.9 106.06 2.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 117.973 0.886 . . . . 6.4000000000000004 110.99 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -62.59 -25.8 68.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.969 -1.014 . . . . 4.3300000000000001 112.903 -178.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -60.18 -56.4 22.09 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.2 0.524 . . . . 6.9900000000000002 110.69 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -73.86 -29.27 62.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.081 -0.509 . . . . 7.4800000000000004 110.415 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -61.4 -46.56 89.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.297 -0.41 . . . . 3.8399999999999999 110.557 179.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -64.78 -38.52 91.28 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.982 -0.554 . . . . 3.7999999999999998 110.381 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 1.3 t -70.1 -26.15 63.84 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.13 -0.486 . . . . 5.0499999999999998 110.503 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.56 -49.77 11.72 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 116.095 -0.502 . . . . 4.3600000000000003 111.401 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.2 pp -61.46 -33.19 73.34 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.132 0.419 . . . . 3.21 112.132 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 427' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -61.84 -12.51 17.84 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.871 0.693 . . . . 5.2699999999999996 112.871 -179.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -67.7 -7.53 27.81 Favored 'General case' 0 C--O 1.235 0.314 0 O-C-N 122.216 -0.302 . . . . 5.7699999999999996 111.51 179.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.654 -0.689 . . . . 5.1100000000000003 110.511 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.0 ptt? . . . . . 0 N--CA 1.476 0.859 0 CA-C-O 120.867 0.365 . . . . 1.6499999999999999 110.492 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 65.3 mm-40 -87.01 142.4 27.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.935 0.398 . . . . 2.04 111.296 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 27.6 pt -127.58 162.51 32.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.862 -0.608 . . . . 1.48 109.874 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 68.5 m-85 -112.35 117.03 31.34 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.57 -0.287 . . . . 2.1699999999999999 110.442 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 36.1 t -106.04 124.65 61.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.439 -0.346 . . . . 1.6499999999999999 110.375 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -100.37 155.72 17.65 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.213 -0.449 . . . . 3.5099999999999998 110.762 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.0 p -128.25 169.16 14.51 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.722 -0.844 . . . . 2.1699999999999999 108.722 178.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 96.2 mt -71.29 -4.38 25.63 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.997 0.369 . . . . 3.0499999999999998 111.997 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.92 11.75 38.07 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.002 0.43 . . . . 2.7000000000000002 110.911 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.85 18.47 74.3 Favored Glycine 0 N--CA 1.451 -0.362 0 CA-C-N 115.935 -0.575 . . . . 2.6400000000000001 112.786 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -95.15 127.0 40.86 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.643 0.259 . . . . 2.5600000000000001 110.402 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.7 m -107.79 126.34 52.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.345 -0.389 . . . . 2.4100000000000001 110.11 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.7 mt -116.48 144.76 23.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 116.289 -0.414 . . . . 1.8300000000000001 110.432 -179.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.33 143.08 30.94 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.94 -0.393 . . . . 2.1899999999999999 109.94 179.251 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.5 mt -138.96 143.12 38.43 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.702 0.287 . . . . 1.3600000000000001 111.594 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -97.32 108.79 21.59 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.987 -0.746 . . . . 2.3999999999999999 108.987 178.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 4.6 m -135.34 168.58 22.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 116.471 -0.331 . . . . 1.25 110.749 -179.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -127.69 159.46 65.99 Favored Pre-proline 0 C--N 1.319 -0.725 0 N-CA-C 109.316 -0.624 . . . . 1.8500000000000001 109.316 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -52.55 -35.98 69.1 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.79 2.326 . . . . 1.78 112.806 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.56 3.36 22.04 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.74 0.644 . . . . 2.1200000000000001 112.74 -179.06 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -79.88 138.22 37.11 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.907 -0.317 . . . . 1.25 111.146 -179.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -86.74 147.91 25.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.049 -0.523 . . . . 1.77 110.488 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 48.5 mm -56.78 -36.48 49.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-O 120.872 0.367 . . . . 1.0600000000000001 110.655 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -58.26 -43.44 87.88 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.9 -0.591 . . . . 2.2200000000000002 109.915 178.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -70.07 -35.83 74.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.74 -0.663 . . . . 1.3300000000000001 110.323 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 98.2 t -62.54 -44.41 99.31 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 N-CA-C 109.646 -0.501 . . . . 0.67000000000000004 109.646 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -63.21 -34.67 78.15 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.176 -0.466 . . . . 1.6899999999999999 110.16 179.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.86 -34.79 78.95 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.054 -0.521 . . . . 1.0800000000000001 109.627 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -68.76 -34.99 76.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.779 -0.646 . . . . 1.48 109.857 178.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 57.5 mt -72.56 -40.85 63.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 108.86 -0.793 . . . . 1.3100000000000001 108.86 178.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -60.57 -37.05 80.04 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.599 -0.728 . . . . 2.0899999999999999 110.626 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -65.13 -30.54 71.47 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.07 -0.514 . . . . 2.0499999999999998 111.751 -179.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -93.12 -49.25 6.09 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 113.074 0.768 . . . . 2.5099999999999998 113.074 -178.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 51.5 mm-40 -88.45 -19.34 26.64 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 113.4 0.889 . . . . 2.1400000000000001 113.4 -177.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.28 24.37 77.04 Favored Glycine 0 N--CA 1.453 -0.202 0 C-N-CA 120.717 -0.754 . . . . 2.0099999999999998 112.57 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 77.1 mt -99.03 129.82 28.77 Favored Pre-proline 0 C--N 1.327 -0.384 0 O-C-N 122.869 -0.195 . . . . 1.8300000000000001 110.642 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -52.1 136.39 53.41 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 123.028 2.485 . . . . 2.04 112.493 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -64.84 -15.22 49.2 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.971 2.448 . . . . 1.52 112.902 -179.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -78.76 -26.91 44.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.996 0.427 . . . . 2.9500000000000002 110.607 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -94.77 -11.15 29.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.215 0.531 . . . . 2.73 110.084 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -78.98 109.9 13.71 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.464 -0.789 . . . . 1.4399999999999999 111.72 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 7.9 mmt180 -111.35 102.16 10.57 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.436 -0.579 . . . . 2.9399999999999999 109.436 178.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 18.0 mt -88.64 135.21 33.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.157 -0.474 . . . . 1.02 111.759 -179.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -129.89 150.16 34.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.846 -0.615 . . . . 2.1400000000000001 110.673 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -133.48 96.04 3.63 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.654 -0.703 . . . . 1.71 109.144 178.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.68 39.81 20.65 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.795 -0.638 . . . . 2.1000000000000001 111.867 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.23 -16.56 61.05 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.734 -0.746 . . . . 1.8400000000000001 113.153 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 42.4 mtmt -93.11 114.57 27.13 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 122.821 -0.223 . . . . 3.4300000000000002 111.157 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -68.35 136.36 53.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.269 -0.423 . . . . 2.7200000000000002 110.365 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 18.6 mt -92.59 122.74 35.31 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.261 -0.427 . . . . 1.1699999999999999 111.883 -178.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -80.13 150.02 30.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.1 -0.5 . . . . 2.6499999999999999 110.475 179.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -65.54 -33.43 75.9 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.791 -0.64 . . . . 1.8300000000000001 111.992 -178.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -85.2 17.09 34.89 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.995 -0.622 . . . . 1.8200000000000001 114.353 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -117.11 165.24 13.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 117.285 0.542 . . . . 2.9300000000000002 110.868 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 19.5 p -109.49 177.78 4.64 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.044 -0.525 . . . . 1.71 109.589 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 75.9 mt -67.22 -36.68 82.2 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.836 0.35 . . . . 1.49 111.111 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.2 m -67.22 -21.76 65.74 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.326 -0.397 . . . . 2.1000000000000001 111.561 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -67.67 -28.34 67.61 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.544 -0.298 . . . . 2.0299999999999998 111.247 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -112.58 14.3 20.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.824 0.345 . . . . 1.76 111.058 -179.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 59.32 38.13 23.22 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.723 -0.672 . . . . 3.3700000000000001 111.455 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 73.7 mt -84.39 107.76 15.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.015 -0.539 . . . . 1.6499999999999999 109.848 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -101.46 -167.06 1.37 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.87 -0.605 . . . . 2.79 110.58 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 56.3 pttt -72.4 144.5 48.16 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.693 0.282 . . . . 3.52 111.261 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 68.84 18.87 8.5 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.61 -0.723 . . . . 3.1200000000000001 112.939 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 51.5 m -76.58 154.74 34.18 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.74 -0.467 . . . . 1.8999999999999999 109.74 178.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.4 m -105.76 119.55 39.44 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.934 0.397 . . . . 2.1600000000000001 111.099 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.4 mp -111.34 148.98 31.81 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.671 -0.695 . . . . 1.4199999999999999 109.193 179.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -116.1 137.56 52.02 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 120.721 0.296 . . . . 3.1499999999999999 111.188 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 33.4 tp -116.16 115.01 25.25 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.158 -0.474 . . . . 1.54 111.329 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 39.7 t -105.24 132.58 51.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.995 -0.548 . . . . 1.79 110.091 179.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 78.3 mt -91.26 109.55 20.82 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.448 -0.575 . . . . 2.4300000000000002 109.448 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 23.3 ttt180 -92.06 117.69 30.08 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.142 0.496 . . . . 3.5 111.159 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.8 mt -89.01 155.89 19.2 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.689 -0.687 . . . . 2.9900000000000002 110.3 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.1 mmt180 . . . . . 0 C--N 1.326 -0.444 0 CA-C-O 121.27 0.557 . . . . 3.9199999999999999 109.979 179.063 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.24 0 N-CA-C 110.481 -0.192 . . . . 2.5499999999999998 110.481 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -64.83 147.63 89.59 Favored 'Trans proline' 0 C--O 1.235 0.361 0 C-N-CA 122.645 2.23 . . . . 3.77 111.349 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -49.86 -59.23 4.04 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 113.588 0.959 . . . . 5.3600000000000003 113.588 -178.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -48.91 -52.41 24.7 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.554 0.575 . . . . 6.8899999999999997 112.554 -179.031 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -43.11 77.74 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.348 -0.387 . . . . 4.2000000000000002 111.759 -179.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 395' ' ' ILE . . . . . . . . . . . . . 75.0 mt -66.16 -51.82 55.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.412 -0.358 . . . . 3.7999999999999998 110.399 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -57.78 -40.38 79.7 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.961 -0.563 . . . . 6.5800000000000001 112.099 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -63.72 -43.52 96.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.932 0.396 . . . . 7.46 110.703 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -73.98 -33.9 64.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.95 -0.568 . . . . 4.3099999999999996 111.801 -179.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 30.3 mmt -67.12 -40.94 86.9 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.821 0.343 . . . . 5.7999999999999998 111.269 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -63.76 -24.52 67.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 7.71 112.119 -178.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 31.9 mt -63.29 -23.28 67.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.026 0.441 . . . . 5.6900000000000004 110.879 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 109.78 42.23 1.24 Allowed Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 121.039 -0.6 . . . . 5.8700000000000001 111.614 -179.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -129.49 153.46 80.65 Favored Pre-proline 0 C--N 1.325 -0.464 0 N-CA-C 110.527 -0.175 . . . . 4.8399999999999999 110.527 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -83.82 160.07 14.05 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 122.724 2.283 . . . . 4.7199999999999998 112.612 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 23.7 ttt180 -61.04 -30.83 70.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.579 -0.737 . . . . 4.4400000000000004 110.379 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -56.68 -43.91 80.91 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.563 -0.744 . . . . 4.6900000000000004 110.714 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -71.82 -42.09 67.42 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.707 -0.679 . . . . 3.2599999999999998 112.124 -179.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 4.2 p -61.61 -37.3 77.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 111.989 0.366 . . . . 2.1600000000000001 111.989 -179.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 71.9 t -68.94 -48.21 71.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.648 0.261 . . . . 2.8900000000000001 110.79 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 82.5 mttt -61.3 -44.15 97.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.975 0.417 . . . . 5.5 111.167 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -66.0 -49.59 67.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.915 -0.584 . . . . 2.96 111.725 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 45.3 mt -62.49 -32.38 73.28 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.774 0.657 . . . . 3.4500000000000002 112.774 -179.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 61.4 mmtt -69.18 -45.25 70.44 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.923 -0.311 . . . . 5.8499999999999996 111.721 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 29.0 pt20 -75.28 -26.94 59.15 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.925 0.713 . . . . 5.5300000000000002 112.925 -178.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 41.2 p -94.61 -3.28 49.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.084 0.469 . . . . 5.4199999999999999 111.146 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 61.82 60.85 1.5 Allowed 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.563 0.949 . . . . 6.6399999999999997 113.563 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 72.03 -24.16 0.7 Allowed Glycine 0 CA--C 1.522 0.5 0 N-CA-C 115.945 1.138 . . . . 4.3300000000000001 115.945 177.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.37 103.09 2.32 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 122.0 0.905 . . . . 6.4000000000000004 110.944 -179.543 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -66.24 -20.66 66.18 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 115.023 -0.989 . . . . 4.3300000000000001 112.69 -178.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -61.69 -50.33 72.9 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.481 0.658 . . . . 6.9900000000000002 109.305 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -80.46 -27.11 37.96 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.546 -0.752 . . . . 7.4800000000000004 109.823 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -61.35 -48.09 82.88 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 110.02 -0.363 . . . . 3.8399999999999999 110.02 178.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -65.68 -40.51 92.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.854 -0.612 . . . . 3.7999999999999998 109.685 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 21.6 m -61.41 -39.39 90.56 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.749 -0.659 . . . . 5.0499999999999998 111.069 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.69 -46.84 23.99 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.291 -0.413 . . . . 4.3600000000000003 110.979 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.3 -37.06 76.77 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.988 0.366 . . . . 3.21 111.988 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 427' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -77.25 3.15 13.58 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 113.621 0.971 . . . . 5.2699999999999996 113.621 -178.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -56.94 -20.98 26.54 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.251 0.463 . . . . 5.7699999999999996 112.251 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 14.2 m . . . . . 0 C--O 1.251 1.134 0 CA-C-O 118.61 -0.709 . . . . 5.1100000000000003 111.328 -179.777 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.8 ptt? . . . . . 0 N--CA 1.481 1.094 0 CA-C-O 120.577 0.227 . . . . 1.6499999999999999 110.423 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -109.28 138.17 46.04 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 111.967 0.358 . . . . 2.04 111.967 -179.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 16.0 pt -130.32 159.38 42.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.779 -0.646 . . . . 1.48 109.534 178.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -121.03 123.65 42.91 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.75 0.309 . . . . 2.1699999999999999 110.574 -179.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.4 t -105.42 127.22 60.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.451 -0.34 . . . . 1.6499999999999999 111.008 -179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.1 mmtp -92.65 128.3 38.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.282 -0.417 . . . . 3.5099999999999998 110.829 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.06 164.76 11.56 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.224 -0.444 . . . . 2.1699999999999999 110.751 179.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.5 mt -64.12 -15.56 59.95 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.413 0.523 . . . . 3.0499999999999998 112.413 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -90.79 5.23 49.19 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.936 0.398 . . . . 2.7000000000000002 110.632 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.13 3.97 90.58 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.858 -0.687 . . . . 2.6400000000000001 111.416 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -75.11 148.41 39.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.413 -0.393 . . . . 2.5600000000000001 111.037 -179.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.9 m -119.3 108.19 14.31 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.802 -0.814 . . . . 2.4100000000000001 108.802 178.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 17.9 mt -92.49 126.51 44.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.33 -0.396 . . . . 1.8300000000000001 111.466 -178.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.0 122.6 34.66 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.196 -0.668 . . . . 2.1899999999999999 109.196 178.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 76.2 mt -122.25 137.94 54.66 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 112.429 0.529 . . . . 1.3600000000000001 112.429 -178.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -90.78 108.5 19.87 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.259 -1.015 . . . . 2.3999999999999999 108.259 178.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.9 m -139.49 173.82 10.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.048 0.451 . . . . 1.25 111.056 -178.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 36.5 mm-40 -138.93 157.31 71.8 Favored Pre-proline 0 C--N 1.32 -0.708 0 N-CA-C 107.923 -1.14 . . . . 1.8500000000000001 107.923 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -50.1 -33.04 33.73 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.749 2.299 . . . . 1.78 112.883 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.5 m -74.36 -10.17 59.32 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.799 0.666 . . . . 2.1200000000000001 112.799 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -77.33 135.46 38.38 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.85 -0.426 . . . . 1.25 109.85 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -86.16 150.12 24.63 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.538 -0.301 . . . . 1.77 110.945 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 43.5 mm -55.66 -36.06 41.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-O 121.033 0.444 . . . . 1.0600000000000001 110.427 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -59.42 -41.37 89.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.581 -0.736 . . . . 2.2200000000000002 110.695 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -71.6 -34.84 70.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.032 -0.531 . . . . 1.3300000000000001 110.679 -179.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.8 t -60.62 -42.61 92.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.069 -0.514 . . . . 0.67000000000000004 109.725 179.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.2 mtmt -62.74 -36.39 82.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.926 -0.579 . . . . 1.6899999999999999 110.63 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.45 -35.54 80.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.985 -0.552 . . . . 1.0800000000000001 110.55 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -67.74 -37.34 82.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.018 -0.537 . . . . 1.48 109.909 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 54.2 mt -70.99 -33.05 50.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.027 -0.533 . . . . 1.3100000000000001 110.196 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -64.84 -34.6 78.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.943 -0.571 . . . . 2.0899999999999999 110.803 179.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -81.18 -36.2 30.45 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.291 -0.413 . . . . 2.0499999999999998 111.157 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 75.6 mttt -76.48 -55.38 5.58 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.399 0.518 . . . . 2.5099999999999998 112.399 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 55.7 mm-40 -85.74 -42.29 14.35 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.118 0.414 . . . . 2.1400000000000001 112.118 -178.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 105.55 8.05 35.81 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.614 -0.803 . . . . 2.0099999999999998 111.361 -179.097 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 24.9 mt -89.58 121.09 69.5 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.73 -0.47 . . . . 1.8300000000000001 109.73 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_exo -54.39 135.32 65.26 Favored 'Trans proline' 0 C--N 1.342 0.231 0 C-N-CA 122.907 2.405 . . . . 2.04 111.409 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.23 -22.39 64.65 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 123.302 2.668 . . . . 1.52 112.373 -179.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -77.4 -23.21 50.7 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.928 -0.578 . . . . 2.9500000000000002 110.882 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -102.56 7.74 40.0 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.119 0.485 . . . . 2.73 110.634 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -91.34 176.16 6.66 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.472 -0.785 . . . . 1.4399999999999999 110.475 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.37 94.51 1.08 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.85 -0.796 . . . . 2.9399999999999999 108.85 179.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 16.8 mt -100.18 123.19 44.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.094 0.473 . . . . 1.02 112.263 -178.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 20.0 pt -132.78 163.07 38.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.706 -0.679 . . . . 2.1400000000000001 109.687 178.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -130.09 112.74 13.72 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.465 -0.334 . . . . 1.71 110.281 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.58 35.11 22.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.791 -0.641 . . . . 2.1000000000000001 111.98 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.3 -17.67 56.57 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.771 -0.728 . . . . 1.8400000000000001 113.249 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -95.39 126.27 40.58 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.112 -0.329 . . . . 3.4300000000000002 110.112 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.14 151.08 48.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.054 0.454 . . . . 2.7200000000000002 111.705 -178.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 18.9 mt -108.64 132.52 53.82 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.574 -0.739 . . . . 1.1699999999999999 110.206 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -86.85 146.78 26.08 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.401 -0.363 . . . . 2.6499999999999999 110.667 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -61.76 -34.76 76.43 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 112.713 0.634 . . . . 1.8300000000000001 112.713 -178.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -85.12 14.23 50.56 Favored Glycine 0 N--CA 1.453 -0.217 0 C-N-CA 120.962 -0.637 . . . . 1.8200000000000001 113.043 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 30.1 mmt180 -112.45 152.0 29.23 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.027 0.441 . . . . 2.9300000000000002 110.456 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 68.4 p -99.19 175.26 5.95 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 108.891 -0.781 . . . . 1.71 108.891 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 88.0 mt -68.93 -31.54 70.5 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.357 -0.608 . . . . 1.49 109.357 178.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.89 -28.53 68.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.555 -0.748 . . . . 2.1000000000000001 110.632 178.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -60.34 -32.41 71.23 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.112 -0.495 . . . . 2.0299999999999998 111.118 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -108.82 12.0 25.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.233 -0.44 . . . . 1.76 111.58 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 61.4 30.21 18.85 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.911 -0.586 . . . . 3.3700000000000001 111.707 -179.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 86.4 mt -74.42 116.59 17.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 109.375 -0.602 . . . . 1.6499999999999999 109.375 179.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -109.5 -163.24 0.85 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.953 -0.567 . . . . 2.79 110.306 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.9 pttt -73.86 149.43 41.56 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.677 -0.238 . . . . 3.52 110.815 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 69.41 19.15 7.72 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.711 0.634 . . . . 3.1200000000000001 112.711 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.3 m -82.3 146.76 29.26 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.784 0.326 . . . . 1.8999999999999999 110.328 179.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 10.3 m -105.33 120.9 42.72 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.045 0.45 . . . . 2.1600000000000001 111.539 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.5 mp -102.62 147.27 27.0 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.7 -0.682 . . . . 1.4199999999999999 109.461 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 23.9 m80 -105.57 129.78 53.76 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.579 -0.282 . . . . 3.1499999999999999 110.936 -179.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 29.1 tp -123.4 121.86 36.82 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.254 -0.43 . . . . 1.54 110.781 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -116.88 153.41 18.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.311 -0.404 . . . . 1.79 110.917 179.612 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 95.9 mt -85.89 131.23 34.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.077 0.465 . . . . 2.4300000000000002 111.203 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 12.1 ttt180 -106.16 80.01 1.46 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.858 -0.61 . . . . 3.5 109.501 178.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 77.6 mt -63.18 150.06 43.86 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.726 -0.67 . . . . 2.9900000000000002 111.417 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.5 mmt85 . . . . . 0 C--N 1.322 -0.598 0 CA-C-N 116.072 -0.513 . . . . 3.9199999999999999 110.087 179.782 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 . . . . . 0 N--CA 1.455 -0.203 0 N-CA-C 110.228 -0.286 . . . . 2.5499999999999998 110.228 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_exo -72.67 121.09 7.1 Favored 'Trans proline' 0 C--O 1.235 0.347 0 C-N-CA 123.054 2.503 . . . . 3.77 111.968 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -51.19 -50.34 59.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.873 -0.603 . . . . 5.3600000000000003 112.514 -179.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -55.16 -50.12 70.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.025 -0.534 . . . . 6.8899999999999997 111.918 -179.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 2.1 m -61.18 -45.18 95.67 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.032 -0.531 . . . . 4.2000000000000002 111.29 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 395' ' ' ILE . . . . . . . . . . . . . 75.0 mt -60.64 -48.71 87.48 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.109 0 CA-C-O 120.662 0.268 . . . . 3.7999999999999998 110.848 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 73.3 mttt -58.28 -41.27 84.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 6.5800000000000001 111.925 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -68.33 -36.8 79.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.841 0.353 . . . . 7.46 110.723 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 83.4 mt -68.43 -24.28 64.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.285 -0.416 . . . . 4.3099999999999996 111.051 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 23.1 mmt -68.36 -25.11 64.92 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.04 0.448 . . . . 5.7999999999999998 110.63 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -73.96 -11.43 60.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.886 -0.597 . . . . 7.71 111.416 -179.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 74.9 mt -86.03 16.96 3.79 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.035 0.383 . . . . 5.6900000000000004 112.035 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 62.53 47.3 90.36 Favored Glycine 0 CA--C 1.518 0.227 0 C-N-CA 121.07 -0.586 . . . . 5.8700000000000001 112.589 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -134.51 150.3 73.36 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-O 120.361 0.124 . . . . 4.8399999999999999 110.802 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -69.49 153.35 70.29 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.955 2.437 . . . . 4.7199999999999998 112.204 179.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 25.9 ttt180 -68.76 -41.0 79.47 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.123 0.416 . . . . 4.4400000000000004 112.123 -178.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -59.6 -37.31 78.24 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.405 -0.361 . . . . 4.6900000000000004 111.527 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -61.72 -39.38 91.3 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.244 -0.434 . . . . 3.2599999999999998 110.518 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 55.2 t -66.09 -40.75 88.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.85 -0.614 . . . . 2.1600000000000001 110.11 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 88.6 t -60.24 -46.01 95.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.033 -0.531 . . . . 2.8900000000000001 110.189 179.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 19.2 mttp -67.69 -39.3 84.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.984 -0.553 . . . . 5.5 111.155 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -65.81 -49.2 69.12 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.181 -0.463 . . . . 2.96 111.309 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 46.5 mt -63.63 -30.7 71.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.452 -0.34 . . . . 3.4500000000000002 111.375 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -64.66 -49.06 72.48 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.32 -0.4 . . . . 5.8499999999999996 111.041 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -80.05 -9.73 59.72 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.207 0.817 . . . . 5.5300000000000002 113.207 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 31.4 p -107.75 -4.99 17.59 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.759 0.314 . . . . 5.4199999999999999 110.96 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 55.1 m-80 64.91 55.4 1.19 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.857 -0.611 . . . . 6.6399999999999997 112.501 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 72.71 -6.94 10.05 Favored Glycine 0 CA--C 1.519 0.287 0 CA-C-N 115.864 -0.607 . . . . 4.3300000000000001 114.253 178.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -67.8 93.99 0.43 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.018 0.437 . . . . 6.4000000000000004 110.15 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -59.08 -35.88 74.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.527 -0.76 . . . . 4.3300000000000001 112.287 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -71.94 -43.79 64.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.883 0.373 . . . . 6.9900000000000002 110.674 -179.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -67.78 -39.68 84.04 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.189 -0.46 . . . . 7.4800000000000004 109.861 179.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -61.73 -38.99 89.99 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.779 -0.646 . . . . 3.8399999999999999 110.436 179.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -57.3 -48.8 77.99 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.009 -0.541 . . . . 3.7999999999999998 110.613 179.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.12 -30.88 71.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.053 -0.521 . . . . 5.0499999999999998 111.612 179.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -81.82 -50.25 9.44 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 113.747 1.017 . . . . 4.3600000000000003 113.747 -178.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.3 pp -62.63 -34.25 76.66 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.126 0.788 . . . . 3.21 113.126 -178.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 427' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -67.04 -13.03 61.52 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.341 0.867 . . . . 5.2699999999999996 113.341 -179.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.39 -18.63 57.15 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 120.809 -0.356 . . . . 5.7699999999999996 111.811 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 6.6 m . . . . . 0 C--O 1.247 0.954 0 CA-C-O 118.676 -0.678 . . . . 5.1100000000000003 110.9 -179.372 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 ptt? . . . . . 0 N--CA 1.481 1.099 0 N-CA-C 110.204 -0.295 . . . . 1.6499999999999999 110.204 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 89.2 mm-40 -102.27 135.33 44.06 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.914 0.388 . . . . 2.04 111.582 -179.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.3 pt -126.63 151.93 33.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.027 -0.533 . . . . 1.48 109.916 178.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -108.93 124.75 51.16 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.673 -0.239 . . . . 2.1699999999999999 111.167 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.1 t -111.8 118.83 58.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.42 -0.585 . . . . 1.6499999999999999 109.42 179.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -102.09 132.68 47.81 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.0 0.429 . . . . 3.5099999999999998 111.727 -179.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 26.5 p -99.06 175.85 5.77 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.959 -0.564 . . . . 2.1699999999999999 110.224 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 92.8 mt -79.28 10.61 3.52 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.914 0.388 . . . . 3.0499999999999998 111.7 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -110.04 3.52 20.43 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.318 -0.401 . . . . 2.7000000000000002 110.71 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 80.18 24.88 58.62 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.796 -0.716 . . . . 2.6400000000000001 111.783 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -106.35 134.88 48.79 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.584 0.23 . . . . 2.5600000000000001 110.499 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.1 m -115.64 109.48 17.81 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.961 0.41 . . . . 2.4100000000000001 110.755 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.5 mt -95.26 138.48 20.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.893 -0.594 . . . . 1.8300000000000001 110.428 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.5 m -101.94 115.09 29.78 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.761 -0.459 . . . . 2.1899999999999999 109.761 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.1 mt -105.07 143.32 33.41 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.059 0.456 . . . . 1.3600000000000001 112.124 -179.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -98.97 101.51 12.93 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.46 -0.791 . . . . 2.3999999999999999 109.609 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 16.3 m -138.2 -179.0 2.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.991 -0.549 . . . . 1.25 110.821 -178.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -132.78 157.72 77.62 Favored Pre-proline 0 C--N 1.323 -0.584 0 N-CA-C 109.035 -0.728 . . . . 1.8500000000000001 109.035 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -53.34 -29.67 48.95 Favored 'Trans proline' 0 CA--C 1.533 0.467 0 C-N-CA 122.882 2.388 . . . . 1.78 113.058 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.98 -5.48 48.8 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.14 0.422 . . . . 2.1200000000000001 112.14 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.07 144.04 45.18 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.029 0.442 . . . . 1.25 110.757 -179.693 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -93.48 145.13 24.73 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.798 -0.637 . . . . 1.77 110.075 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 46.1 mm -53.34 -42.77 49.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 O-C-N 123.166 0.291 . . . . 1.0600000000000001 111.469 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -56.59 -44.34 80.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.366 -0.379 . . . . 2.2200000000000002 110.7 179.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -67.27 -37.31 83.26 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.961 -0.563 . . . . 1.3300000000000001 110.667 -179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 87.2 t -61.37 -43.49 96.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.086 -0.506 . . . . 0.67000000000000004 110.462 179.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.8 mtmt -63.33 -34.17 77.12 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.209 -0.451 . . . . 1.6899999999999999 110.976 179.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -64.96 -32.81 74.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.086 -0.506 . . . . 1.0800000000000001 110.132 179.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.4 mttt -71.04 -37.43 72.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.009 -0.542 . . . . 1.48 109.827 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.3 mt -66.77 -38.23 81.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 109.084 -0.71 . . . . 1.3100000000000001 109.084 178.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -65.63 -37.34 86.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.753 -0.658 . . . . 2.0899999999999999 110.596 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -67.72 -37.17 81.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.219 -0.446 . . . . 2.0499999999999998 112.019 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -87.3 -54.48 4.28 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 113.046 0.758 . . . . 2.5099999999999998 113.046 -178.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -77.36 -35.85 54.16 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.702 0.63 . . . . 2.1400000000000001 112.702 -178.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 91.57 13.77 57.83 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.454 -0.879 . . . . 2.0099999999999998 111.835 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.0 mt -95.17 123.77 56.01 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 110.075 -0.343 . . . . 1.8300000000000001 110.075 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -52.98 137.81 61.84 Favored 'Trans proline' 0 CA--C 1.532 0.378 0 C-N-CA 123.083 2.522 . . . . 2.04 112.33 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -62.57 -18.7 64.99 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.943 2.429 . . . . 1.52 111.974 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -71.13 -25.4 62.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.953 -0.567 . . . . 2.9500000000000002 110.238 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -102.15 6.65 40.91 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.043 -0.526 . . . . 2.73 110.368 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -98.6 114.95 27.61 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.924 -0.58 . . . . 1.4399999999999999 111.661 -179.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 66.6 mtp180 -116.59 101.59 8.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.241 -0.436 . . . . 2.9399999999999999 109.979 178.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 21.7 mt -77.33 128.26 33.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.894 0.378 . . . . 1.02 111.26 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 53.5 mt -124.88 137.63 56.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.669 -0.696 . . . . 2.1400000000000001 110.772 -179.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -132.7 113.22 12.73 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.038 -0.727 . . . . 1.71 109.038 178.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 63.16 30.36 16.01 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.22 -0.446 . . . . 2.1000000000000001 112.01 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 86.04 4.06 84.7 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.871 -0.681 . . . . 1.8400000000000001 113.089 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 41.6 mtmt -116.49 136.75 52.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.766 0.283 . . . . 3.4300000000000002 110.906 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -73.6 145.87 45.1 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.199 -0.455 . . . . 2.7200000000000002 110.529 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 26.1 mt -105.33 140.4 38.52 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.297 -0.41 . . . . 1.1699999999999999 110.594 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -80.47 138.41 36.57 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.715 -0.476 . . . . 2.6499999999999999 109.715 179.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -64.77 -28.37 69.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.948 0.404 . . . . 1.8300000000000001 111.06 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -86.37 22.85 11.23 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 115.82 -0.627 . . . . 1.8200000000000001 112.808 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 37.0 mmt180 -120.86 160.83 22.62 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.911 -0.403 . . . . 2.9300000000000002 109.911 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 35.2 p -103.8 174.44 5.87 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.922 -0.399 . . . . 1.71 109.922 179.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 85.8 mt -66.86 -35.99 81.31 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.168 0.508 . . . . 1.49 110.346 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.4 m -65.88 -21.85 66.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.828 -0.624 . . . . 2.1000000000000001 110.339 178.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -68.14 -21.51 64.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.784 -0.644 . . . . 2.0299999999999998 112.158 -179.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -120.98 16.48 11.7 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.705 0.288 . . . . 1.76 111.271 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 60.99 28.71 18.49 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.729 -0.669 . . . . 3.3700000000000001 111.617 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 67.2 mt -78.76 114.53 19.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.212 -0.449 . . . . 1.6499999999999999 110.658 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -107.92 -165.99 1.1 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.753 -0.658 . . . . 2.79 110.117 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.77 152.57 40.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.695 -0.23 . . . . 3.52 110.985 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 73.16 1.7 4.1 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 112.688 0.625 . . . . 3.1200000000000001 112.688 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.0 m -74.06 146.24 43.83 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.755 0.312 . . . . 1.8999999999999999 110.963 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.0 m -108.93 129.13 55.42 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.814 0.34 . . . . 2.1600000000000001 111.192 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.2 mp -115.97 152.44 33.49 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.81 -0.811 . . . . 1.4199999999999999 108.81 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 70.5 m80 -111.04 150.54 29.19 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.645 0.259 . . . . 3.1499999999999999 111.193 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 23.2 tp -129.84 109.79 11.21 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.314 -0.403 . . . . 1.54 111.245 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 16.0 t -96.18 126.87 48.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 109.901 -0.407 . . . . 1.79 109.901 179.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 63.9 mt -74.46 112.34 10.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.947 -0.57 . . . . 2.4300000000000002 109.903 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 29.3 ttt180 -85.37 103.25 14.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.119 -0.491 . . . . 3.5 111.236 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 77.9 mt -73.77 126.25 29.95 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.007 -0.542 . . . . 2.9900000000000002 109.796 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 11.3 mmt180 . . . . . 0 C--N 1.324 -0.514 0 CA-C-O 120.89 0.376 . . . . 3.9199999999999999 111.398 -179.23 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.451 -0.383 0 CA-C-O 120.721 0.296 . . . . 2.5499999999999998 110.884 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -64.77 141.56 72.5 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.656 2.237 . . . . 3.77 111.137 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -53.96 -41.08 67.41 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.605 0.594 . . . . 5.3600000000000003 112.605 -179.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -55.37 -52.58 63.07 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.932 0.396 . . . . 6.8899999999999997 111.72 -179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.44 -36.67 83.15 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.195 -0.457 . . . . 4.2000000000000002 110.974 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 395' ' ' ILE . . . . . . . . . . . . . 93.1 mt -63.17 -42.37 96.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.075 -0.512 . . . . 3.7999999999999998 110.317 179.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 24.1 mmtp -58.61 -41.2 85.31 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.481 -0.327 . . . . 6.5800000000000001 110.913 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -63.48 -41.71 98.57 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.151 -0.477 . . . . 7.46 110.794 179.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 77.8 mt -73.44 -27.92 61.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.056 -0.52 . . . . 4.3099999999999996 111.646 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 31.4 mmt -67.62 -41.9 83.22 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.425 -0.352 . . . . 5.7999999999999998 111.17 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -61.51 -24.39 66.57 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.118 -0.492 . . . . 7.71 111.699 -179.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 44.9 mt -68.93 -17.5 63.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 5.6900000000000004 111.0 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 90.93 34.66 7.56 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.719 -0.753 . . . . 5.8700000000000001 112.36 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -113.8 149.88 42.5 Favored Pre-proline 0 C--N 1.325 -0.47 0 N-CA-C 110.531 -0.174 . . . . 4.8399999999999999 110.531 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -67.03 142.62 62.46 Favored 'Trans proline' 0 CA--C 1.531 0.329 0 C-N-CA 122.474 2.116 . . . . 4.7199999999999998 111.9 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -65.35 -33.81 76.83 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.394 -0.366 . . . . 4.4400000000000004 111.447 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -62.56 -38.69 91.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.266 -0.424 . . . . 4.6900000000000004 110.764 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -65.34 -33.94 77.14 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.163 0.506 . . . . 3.2599999999999998 109.678 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 54.0 t -63.99 -41.73 93.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.347 -0.842 . . . . 2.1600000000000001 109.432 179.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 88.0 t -59.93 -47.57 91.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.916 -0.584 . . . . 2.8900000000000001 110.276 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 34.3 mttp -60.3 -47.5 85.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.663 -0.698 . . . . 5.5 111.079 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -67.18 -44.91 78.5 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.746 -0.661 . . . . 2.96 111.96 -178.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -63.93 -31.26 72.39 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.94 0.348 . . . . 3.4500000000000002 111.94 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 32.3 mmtt -71.58 -45.91 60.85 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.801 0.297 . . . . 5.8499999999999996 111.801 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -72.05 -27.82 62.94 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.196 0.443 . . . . 5.5300000000000002 112.196 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 39.5 p -92.4 -14.48 28.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.816 0.341 . . . . 5.4199999999999999 111.238 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 59.81 62.42 1.69 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 113.039 0.755 . . . . 6.6399999999999997 113.039 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 86.33 -12.21 61.25 Favored Glycine 0 CA--C 1.518 0.248 0 C-N-CA 120.523 -0.846 . . . . 4.3300000000000001 114.051 178.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -73.43 79.76 1.4 Allowed 'General case' 0 C--N 1.321 -0.668 0 O-C-N 122.348 -0.501 . . . . 6.4000000000000004 110.117 179.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -58.62 -42.32 87.95 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.155 -0.475 . . . . 4.3300000000000001 112.135 -179.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -65.11 -37.71 88.33 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.295 0.569 . . . . 6.9900000000000002 110.542 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -73.34 -38.16 65.86 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.659 -0.7 . . . . 7.4800000000000004 109.163 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -61.88 -42.65 99.31 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.549 -0.751 . . . . 3.8399999999999999 110.408 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -58.93 -42.11 88.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.129 0.49 . . . . 3.7999999999999998 110.09 179.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 71.6 m -70.49 -37.86 74.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.85 -0.614 . . . . 5.0499999999999998 110.867 179.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -71.38 -48.85 47.44 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 113.058 0.762 . . . . 4.3600000000000003 113.058 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.6 pp -67.3 -34.51 77.52 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.154 0.427 . . . . 3.21 112.154 -178.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 427' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -89.08 1.62 55.31 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.216 0.45 . . . . 5.2699999999999996 112.216 -179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -59.9 -19.67 52.9 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.842 0.353 . . . . 5.7699999999999996 111.698 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 41.0 m . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.244 -0.884 . . . . 5.1100000000000003 109.981 179.237 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 ptt? . . . . . 0 N--CA 1.483 1.183 0 N-CA-C 110.092 -0.336 . . . . 1.6499999999999999 110.092 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 77.1 mm-40 -107.42 138.68 43.18 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.659 0.266 . . . . 2.04 110.71 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 32.3 pt -124.15 163.64 23.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.439 -0.346 . . . . 1.48 110.092 179.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -117.65 122.79 44.52 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.787 0.327 . . . . 2.1699999999999999 110.914 -179.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 56.1 t -106.74 122.39 60.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.287 -0.415 . . . . 1.6499999999999999 109.988 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -109.52 137.33 47.52 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.197 0.523 . . . . 3.5099999999999998 111.395 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.27 159.08 16.91 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.675 -0.693 . . . . 2.1699999999999999 109.554 179.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 55.8 mt -64.57 -6.84 8.4 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.112 0.412 . . . . 3.0499999999999998 112.112 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.9 p -88.96 -10.52 47.43 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.058 0.456 . . . . 2.7000000000000002 110.338 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.47 -9.02 52.78 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.97 -0.559 . . . . 2.6400000000000001 112.19 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -68.18 143.6 55.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.873 0.368 . . . . 2.5600000000000001 111.514 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.7 m -136.3 111.6 9.11 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.457 -0.571 . . . . 2.4100000000000001 109.457 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.5 mt -112.43 148.69 15.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.534 -0.303 . . . . 1.8300000000000001 110.717 -178.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 7.9 m -96.83 142.41 28.86 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.298 -0.63 . . . . 2.1899999999999999 109.298 178.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 17.9 mt -133.41 131.19 39.68 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.843 0.354 . . . . 1.3600000000000001 111.464 179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -85.99 109.45 18.79 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.786 -0.643 . . . . 2.3999999999999999 109.316 178.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 16.8 m -134.0 -169.8 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.93 -0.577 . . . . 1.25 110.732 -179.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -153.26 153.96 30.11 Favored Pre-proline 0 C--N 1.322 -0.621 0 N-CA-C 107.408 -1.33 . . . . 1.8500000000000001 107.408 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_exo -53.64 -31.67 61.19 Favored 'Trans proline' 0 CA--C 1.528 0.199 0 C-N-CA 122.208 1.939 . . . . 1.78 112.122 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.5 1.42 22.41 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.046 0.758 . . . . 2.1200000000000001 113.046 -179.055 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -89.0 137.79 31.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.83 0.347 . . . . 1.25 110.161 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.07 154.2 24.51 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.247 -0.433 . . . . 1.77 111.084 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 34.3 mm -56.3 -41.32 70.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.369 -0.378 . . . . 1.0600000000000001 110.9 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -57.45 -37.47 72.9 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.108 -0.496 . . . . 2.2200000000000002 110.677 179.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -67.81 -32.5 73.1 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.076 -0.511 . . . . 1.3300000000000001 110.435 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 46.2 t -69.28 -40.68 80.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 108.91 -0.774 . . . . 0.67000000000000004 108.91 178.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.7 mmmm -59.03 -43.28 91.6 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.527 -0.761 . . . . 1.6899999999999999 109.871 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.01 -41.44 96.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.485 -0.78 . . . . 1.0800000000000001 110.7 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.4 mtmm -65.11 -36.84 85.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.008 -0.542 . . . . 1.48 110.944 179.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 81.7 mt -66.48 -38.06 80.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 109.973 -0.38 . . . . 1.3100000000000001 109.973 178.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -68.7 -31.8 71.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.036 0.446 . . . . 2.0899999999999999 110.481 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -74.64 -22.98 58.61 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.843 0.354 . . . . 2.0499999999999998 111.28 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -97.45 -43.52 7.24 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.216 0.45 . . . . 2.5099999999999998 112.216 -179.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 53.7 mm-40 -98.12 -31.27 12.2 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.131 0.789 . . . . 2.1400000000000001 113.131 -178.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 91.75 5.47 66.52 Favored Glycine 0 C--N 1.324 -0.134 0 C-N-CA 120.533 -0.841 . . . . 2.0099999999999998 112.152 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 65.7 mt -84.96 125.09 71.52 Favored Pre-proline 0 C--N 1.328 -0.362 0 N-CA-C 110.395 -0.224 . . . . 1.8300000000000001 110.395 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_exo -55.09 140.93 80.55 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.875 2.383 . . . . 2.04 111.737 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -64.1 -13.0 35.15 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.873 2.382 . . . . 1.52 112.432 -179.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.58 -23.93 53.49 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.031 -0.531 . . . . 2.9500000000000002 110.098 179.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -100.16 -15.93 17.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.85 -0.614 . . . . 2.73 110.555 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -75.84 125.05 28.35 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.96 -0.564 . . . . 1.4399999999999999 111.197 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 57.2 mtt180 -128.62 103.46 7.11 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.205 -0.452 . . . . 2.9399999999999999 109.921 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.8 mt -90.06 132.11 35.57 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.343 0.498 . . . . 1.02 112.343 -178.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.1 mt -120.93 141.83 39.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.646 -0.706 . . . . 2.1400000000000001 109.418 179.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -128.7 102.72 6.7 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.461 -0.336 . . . . 1.71 110.279 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 63.23 12.53 6.2 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.825 -0.625 . . . . 2.1000000000000001 112.629 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 111.15 -6.88 28.9 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.863 -0.684 . . . . 1.8400000000000001 112.09 -179.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 82.8 mttt -91.42 137.29 32.48 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.297 -0.26 . . . . 3.4300000000000002 110.297 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -76.26 123.21 25.55 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 123.432 0.457 . . . . 2.7200000000000002 110.244 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 42.8 mt -92.6 122.87 35.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.229 -0.441 . . . . 1.1699999999999999 110.864 -179.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -93.11 145.43 24.41 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.025 -0.534 . . . . 2.6499999999999999 110.205 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -58.07 -42.12 84.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 1.8300000000000001 112.197 -179.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.86 41.49 2.59 Favored Glycine 0 CA--C 1.519 0.33 0 C-N-CA 121.339 -0.458 . . . . 1.8200000000000001 114.201 -178.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -134.58 158.78 43.12 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.263 -0.643 . . . . 2.9300000000000002 109.263 179.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -100.7 155.44 17.89 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.912 -0.403 . . . . 1.71 109.912 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 92.2 mt -59.63 -38.32 81.04 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.828 0.346 . . . . 1.49 111.475 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.27 -20.31 65.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.267 -0.424 . . . . 2.1000000000000001 111.757 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -69.18 -31.91 70.85 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.818 0.342 . . . . 2.0299999999999998 110.677 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -98.08 9.86 41.83 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.195 -0.457 . . . . 1.76 111.4 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 65.02 29.36 12.22 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.952 -0.567 . . . . 3.3700000000000001 111.142 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 83.0 mt -77.47 121.09 29.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.988 -0.551 . . . . 1.6499999999999999 110.249 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -113.24 -164.35 0.91 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.588 -0.733 . . . . 2.79 110.155 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 56.9 pttt -73.64 147.53 43.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.596 0.236 . . . . 3.52 110.43 179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 64.28 28.97 13.87 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.99 0.737 . . . . 3.1200000000000001 112.99 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 50.4 m -84.38 140.81 31.31 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.577 -0.527 . . . . 1.8999999999999999 109.577 178.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -94.18 114.29 26.38 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.431 -0.35 . . . . 2.1600000000000001 111.305 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.0 mp -106.52 141.71 37.36 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.158 -0.682 . . . . 1.4199999999999999 109.158 178.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -106.74 147.21 29.9 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 111.53 0.196 . . . . 3.1499999999999999 111.53 -179.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 27.7 tp -120.8 116.33 25.01 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.095 0.474 . . . . 1.54 111.482 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -96.29 143.2 12.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.819 -0.628 . . . . 1.79 110.004 179.104 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 12.4 mt -86.49 134.92 33.63 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.172 -0.467 . . . . 2.4300000000000002 111.314 -179.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -112.48 129.94 56.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.034 -0.53 . . . . 3.5 110.359 179.303 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 5.9 mt -118.41 155.36 30.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.882 0.372 . . . . 2.9900000000000002 111.39 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 32.0 mmt180 . . . . . 0 C--N 1.326 -0.431 0 CA-C-N 116.116 -0.493 . . . . 3.9199999999999999 110.002 178.78 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 . . . . . 0 N--CA 1.455 -0.212 0 N-CA-C 109.733 -0.469 . . . . 2.5499999999999998 109.733 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -67.52 130.04 21.39 Favored 'Trans proline' 0 C--O 1.235 0.366 0 C-N-CA 122.55 2.167 . . . . 3.77 111.124 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -54.1 -39.23 66.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.164 -0.471 . . . . 5.3600000000000003 111.038 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -59.38 -51.11 71.33 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.778 -0.647 . . . . 6.8899999999999997 110.301 179.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 26.1 m -59.24 -45.25 91.67 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.907 -0.588 . . . . 4.2000000000000002 111.091 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 395' ' ' ILE . . . . . . . . . . . . . 78.3 mt -58.09 -49.02 82.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 3.7999999999999998 110.561 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 85.8 mttt -60.0 -42.26 93.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 6.5800000000000001 112.001 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -62.87 -41.24 99.31 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.887 0.375 . . . . 7.46 110.981 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 80.8 mt -72.79 -26.49 61.54 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.083 -0.508 . . . . 4.3099999999999996 111.464 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 30.7 mmt -62.35 -40.25 95.77 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.315 -0.402 . . . . 5.7999999999999998 111.293 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -70.45 -17.79 62.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.865 -0.607 . . . . 7.71 112.138 -178.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 94.5 mt -69.51 -16.26 63.41 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.837 0.351 . . . . 5.6900000000000004 111.75 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 96.87 32.57 6.45 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.711 -0.757 . . . . 5.8700000000000001 112.178 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -126.4 144.58 49.86 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 110.486 -0.191 . . . . 4.8399999999999999 110.486 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -72.77 162.78 40.26 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.697 2.265 . . . . 4.7199999999999998 111.999 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 14.2 ttt180 -63.51 -28.3 69.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.835 -0.62 . . . . 4.4400000000000004 111.033 -179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -56.21 -48.88 75.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.862 -0.608 . . . . 4.6900000000000004 111.209 179.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -64.94 -35.74 82.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.824 -0.625 . . . . 3.2599999999999998 110.644 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 73.9 t -63.22 -50.54 78.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.823 -0.626 . . . . 2.1600000000000001 110.796 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 59.8 t -60.2 -44.31 95.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.502 -0.317 . . . . 2.8900000000000001 111.403 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -64.15 -50.4 68.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.296 -0.411 . . . . 5.5 111.72 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -63.54 -50.04 71.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 2.96 111.703 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -59.59 -30.45 68.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.332 -0.395 . . . . 3.4500000000000002 111.969 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 23.5 mmtt -67.35 -48.3 67.88 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.418 -0.355 . . . . 5.8499999999999996 111.128 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 23.8 pt20 -76.09 -30.96 58.48 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 113.147 0.795 . . . . 5.5300000000000002 113.147 -179.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 65.4 p -84.02 -8.14 59.21 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.007 0.432 . . . . 5.4199999999999999 110.915 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 61.96 61.1 1.42 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.366 -0.834 . . . . 6.6399999999999997 112.811 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 74.27 -23.15 1.2 Allowed Glycine 0 CA--C 1.521 0.41 0 CA-C-N 115.493 -0.776 . . . . 4.3300000000000001 114.928 178.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.91 113.43 6.32 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 117.868 0.834 . . . . 6.4000000000000004 111.807 -179.291 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -73.29 -20.61 60.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.942 -1.026 . . . . 4.3300000000000001 112.274 -178.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -61.93 -55.63 27.53 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.36 0.6 . . . . 6.9900000000000002 110.041 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -75.13 -24.56 58.01 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.679 -0.692 . . . . 7.4800000000000004 110.4 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -61.61 -46.69 88.74 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.003 -0.739 . . . . 3.8399999999999999 109.003 178.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -64.47 -38.84 92.43 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.85 -0.613 . . . . 3.7999999999999998 109.693 179.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 49.1 m -66.98 -31.3 71.77 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.049 -0.523 . . . . 5.0499999999999998 110.781 178.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.65 -49.41 10.52 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.773 0.657 . . . . 4.3600000000000003 112.773 -179.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 4.2 pp -64.88 -33.82 76.92 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 114.599 1.333 . . . . 3.21 114.599 -177.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 427' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -76.34 0.74 18.36 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 113.174 0.805 . . . . 5.2699999999999996 113.174 -178.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -50.93 -46.05 60.73 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.956 0.724 . . . . 5.7699999999999996 112.956 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 9.5 m . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.549 -0.739 . . . . 5.1100000000000003 110.361 -179.951 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 ptt? . . . . . 0 N--CA 1.481 1.09 0 CA-C-O 120.623 0.249 . . . . 1.6499999999999999 110.365 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -105.93 135.18 47.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.864 0.364 . . . . 2.04 111.753 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.1 pt -129.75 165.22 30.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 109.316 -0.624 . . . . 1.48 109.316 178.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -122.54 127.5 49.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.646 0.26 . . . . 2.1699999999999999 110.622 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 44.3 t -110.17 124.84 67.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 116.504 -0.317 . . . . 1.6499999999999999 110.331 179.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -91.71 149.63 21.52 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.417 -0.356 . . . . 3.5099999999999998 110.625 179.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.3 p -126.1 167.84 14.82 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.988 -0.551 . . . . 2.1699999999999999 109.605 179.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 33.0 mt -65.22 -23.3 67.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.067 0.461 . . . . 3.0499999999999998 110.454 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.4 -5.53 56.63 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.572 -0.74 . . . . 2.7000000000000002 111.124 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.18 30.12 57.59 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 121.051 -0.595 . . . . 2.6400000000000001 112.523 179.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.499 ' HZ3' ' CD ' ' A' ' 34' ' ' GLU . 36.5 ttpt -104.42 129.77 52.36 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 122.774 -0.251 . . . . 2.5600000000000001 110.574 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.2 m -87.85 112.01 22.02 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.316 -0.402 . . . . 2.4100000000000001 110.388 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 49.0 mt -96.59 116.07 37.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.402 -0.363 . . . . 1.8300000000000001 110.6 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.58 126.93 32.85 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.717 -0.845 . . . . 2.1899999999999999 108.717 178.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.5 mt -126.96 139.2 53.21 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.988 0.736 . . . . 1.3600000000000001 112.988 -178.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -95.13 106.74 18.77 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 114.855 -1.066 . . . . 2.3999999999999999 108.716 178.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 6.4 m -140.61 171.05 13.59 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-O 120.87 0.366 . . . . 1.25 110.777 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -124.34 153.35 68.9 Favored Pre-proline 0 C--N 1.319 -0.721 0 N-CA-C 108.903 -0.777 . . . . 1.8500000000000001 108.903 178.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_exo -53.49 -35.87 77.77 Favored 'Trans proline' 0 CA--C 1.53 0.305 0 C-N-CA 122.45 2.1 . . . . 1.78 112.177 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.1 m -85.02 14.56 4.82 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.54 0.571 . . . . 2.1200000000000001 112.54 -179.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -92.61 135.69 33.86 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.213 -0.662 . . . . 1.25 109.213 178.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.45 147.79 37.68 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.269 -0.423 . . . . 1.77 111.272 -178.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 47.3 mm -56.35 -37.41 50.62 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 CA-C-N 116.48 -0.327 . . . . 1.0600000000000001 110.661 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -57.76 -40.5 79.92 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.244 -0.435 . . . . 2.2200000000000002 110.673 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -69.34 -35.13 75.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.023 -0.535 . . . . 1.3300000000000001 109.839 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 59.7 t -65.54 -41.72 91.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 109.133 -0.692 . . . . 0.67000000000000004 109.133 178.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.4 mmmm -60.98 -40.37 93.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.737 -0.665 . . . . 1.6899999999999999 109.713 178.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.47 -36.26 82.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.82 -0.627 . . . . 1.0800000000000001 110.173 179.127 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -65.74 -35.82 81.82 Favored 'General case' 0 C--N 1.334 -0.082 0 CA-C-N 116.132 -0.485 . . . . 1.48 110.112 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 79.5 mt -69.79 -38.31 75.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 108.801 -0.814 . . . . 1.3100000000000001 108.801 178.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -63.95 -30.4 71.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.529 -0.759 . . . . 2.0899999999999999 110.473 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -70.41 -17.25 63.01 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.005 -0.543 . . . . 2.0499999999999998 110.824 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -107.6 -54.34 2.5 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.105 -0.498 . . . . 2.5099999999999998 112.014 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.499 ' CD ' ' HZ3' ' A' ' 11' ' ' LYS . 23.3 mm-40 -79.12 -36.19 41.02 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 111.916 0.339 . . . . 2.1400000000000001 111.916 -178.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 94.87 -15.65 62.95 Favored Glycine 0 C--O 1.229 -0.189 0 C-N-CA 120.836 -0.697 . . . . 2.0099999999999998 112.03 -179.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 54.2 mt -69.56 126.61 92.7 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 115.905 -0.148 . . . . 1.8300000000000001 110.746 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo -58.68 145.87 94.07 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.124 2.549 . . . . 2.04 112.235 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -60.05 -21.51 65.6 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.263 2.642 . . . . 1.52 112.638 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.55 -19.76 65.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.265 -0.425 . . . . 2.9500000000000002 111.735 -179.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -114.01 9.06 17.29 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.086 0.469 . . . . 2.73 110.249 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 -98.85 108.84 21.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.622 -0.717 . . . . 1.4399999999999999 110.925 -179.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 11.1 mmt85 -104.8 104.43 14.21 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.019 0.438 . . . . 2.9399999999999999 109.866 178.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.9 mt -102.15 134.65 45.06 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.741 -0.663 . . . . 1.02 111.699 -178.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 10.8 pt -138.73 160.97 30.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.989 -0.55 . . . . 2.1400000000000001 110.185 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -134.91 106.24 6.77 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.423 -0.584 . . . . 1.71 109.423 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.92 33.42 19.87 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.086 -0.506 . . . . 2.1000000000000001 111.725 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 99.95 -31.48 8.38 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.888 -0.673 . . . . 1.8400000000000001 113.408 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -78.42 130.27 35.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.849 0.324 . . . . 3.4300000000000002 111.404 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.77 140.94 56.68 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.914 -0.585 . . . . 2.7200000000000002 110.529 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 72.0 mt -97.58 113.01 24.65 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.57 -0.286 . . . . 1.1699999999999999 110.798 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -76.87 133.06 39.41 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.282 -0.417 . . . . 2.6499999999999999 109.978 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -58.94 -29.13 66.9 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.919 -0.582 . . . . 1.8300000000000001 112.209 -179.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.53 2.16 83.36 Favored Glycine 0 CA--C 1.52 0.354 0 C-N-CA 121.055 -0.593 . . . . 1.8200000000000001 113.719 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.7 mmt180 -107.99 166.12 10.96 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.073 0.437 . . . . 2.9300000000000002 110.328 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 76.9 p -105.04 177.39 4.86 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.782 -0.451 . . . . 1.71 109.782 179.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 94.8 mt -67.19 -34.87 78.42 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.971 0.415 . . . . 1.49 109.882 179.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -27.47 68.93 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.958 -0.565 . . . . 2.1000000000000001 111.368 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -65.23 -23.34 67.04 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.908 0.385 . . . . 2.0299999999999998 111.704 -179.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -115.03 16.07 17.13 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.386 -0.37 . . . . 1.76 110.929 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 59.66 29.09 18.64 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.769 -0.651 . . . . 3.3700000000000001 111.658 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 76.7 mt -77.48 119.61 26.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.044 -0.526 . . . . 1.6499999999999999 110.335 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 15.0 mt-30 -110.96 -167.99 1.25 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.67 -0.695 . . . . 2.79 109.496 -179.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 24.0 pttt -73.3 152.73 40.84 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 121.01 -0.276 . . . . 3.52 110.412 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 70.4 -1.53 2.48 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.574 0.583 . . . . 3.1200000000000001 112.574 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 69.1 m -69.88 137.19 51.45 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 110.235 -0.283 . . . . 1.8999999999999999 110.235 179.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.4 m -96.57 120.41 36.84 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.168 0.509 . . . . 2.1600000000000001 111.713 -179.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.7 mp -98.73 156.43 16.84 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.551 -0.907 . . . . 1.4199999999999999 108.551 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 72.7 m80 -117.03 125.44 51.35 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.862 0.363 . . . . 3.1499999999999999 111.937 -179.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 47.5 tp -115.58 120.36 39.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.921 -0.582 . . . . 1.54 110.521 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.2 t -112.74 138.89 40.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.005 -0.543 . . . . 1.79 110.678 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.8 mt -72.05 122.82 21.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.84 -0.618 . . . . 2.4300000000000002 110.343 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 59.3 ttt180 -89.92 104.5 17.06 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.29 -0.414 . . . . 3.5 110.553 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.4 mp -69.29 113.35 6.55 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.909 -0.587 . . . . 2.9900000000000002 110.546 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 8.6 mmt85 . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 116.05 -0.523 . . . . 3.9199999999999999 110.317 179.672 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.257 0 CA-C-O 120.605 0.24 . . . . 2.5499999999999998 110.423 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_exo -71.42 136.27 28.33 Favored 'Trans proline' 0 C--O 1.237 0.434 0 C-N-CA 122.792 2.328 . . . . 3.77 111.44 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.75 -36.14 69.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.231 -0.441 . . . . 5.3600000000000003 112.066 -179.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -56.79 -52.89 63.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.045 0.45 . . . . 6.8899999999999997 110.9 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -67.47 -36.24 80.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.886 -0.597 . . . . 4.2000000000000002 110.948 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 395' ' ' ILE . . . . . . . . . . . . . 74.1 mt -59.59 -52.28 62.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.058 -0.519 . . . . 3.7999999999999998 110.224 179.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 31.8 mttp -56.29 -42.7 77.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.355 -0.384 . . . . 6.5800000000000001 111.445 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -61.95 -39.01 90.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.276 -0.42 . . . . 7.46 111.23 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 90.4 mt -76.71 -31.67 57.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.401 -0.363 . . . . 4.3099999999999996 111.316 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 35.0 mmt -66.97 -39.96 87.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.075 0.464 . . . . 5.7999999999999998 110.0 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -62.38 -28.26 69.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.572 -0.74 . . . . 7.71 111.975 -179.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 38.2 mt -63.69 -26.83 68.84 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.071 0.462 . . . . 5.6900000000000004 110.59 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 111.61 27.1 4.23 Favored Glycine 0 N--CA 1.446 -0.638 0 N-CA-C 111.483 -0.647 . . . . 5.8700000000000001 111.483 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -113.08 143.21 28.72 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-O 120.652 0.263 . . . . 4.8399999999999999 110.91 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.88 164.62 31.45 Favored 'Trans proline' 0 C--O 1.236 0.418 0 C-N-CA 123.022 2.481 . . . . 4.7199999999999998 112.949 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -64.12 -28.26 69.65 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.796 -0.638 . . . . 4.4400000000000004 111.408 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 406' ' ' ASP . . . . . 0.427 ' CG ' ' HZ3' ' B' ' 410' ' ' LYS . 33.4 t70 -63.32 -37.71 88.33 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.011 0.434 . . . . 4.6900000000000004 110.448 179.19 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -68.56 -45.19 72.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.8 -0.637 . . . . 3.2599999999999998 111.453 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 14.6 p -63.22 -41.23 92.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 N-CA-C 112.091 0.404 . . . . 2.1600000000000001 112.091 -179.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 74.7 t -64.23 -50.23 77.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.902 0.382 . . . . 2.8900000000000001 111.143 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 410' ' ' LYS . . . . . 0.427 ' HZ3' ' CG ' ' B' ' 406' ' ' ASP . 65.9 mttt -62.85 -40.52 97.69 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.295 -0.411 . . . . 5.5 111.706 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -67.89 -45.43 74.47 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.296 -0.411 . . . . 2.96 110.979 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -61.26 -33.72 74.0 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.198 -0.456 . . . . 3.4500000000000002 111.543 -179.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 42.3 mmtt -69.76 -50.81 39.67 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.121 0.415 . . . . 5.8499999999999996 112.121 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -70.29 -23.83 62.93 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 113.17 0.804 . . . . 5.5300000000000002 113.17 -178.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 68.6 p -99.01 -5.02 31.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.005 0.431 . . . . 5.4199999999999999 110.973 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 57.76 61.72 2.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.494 -0.775 . . . . 6.6399999999999997 112.96 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 76.92 -14.46 7.46 Favored Glycine 0 CA--C 1.519 0.314 0 N-CA-C 114.902 0.721 . . . . 4.3300000000000001 114.902 177.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -71.32 94.16 1.19 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 117.733 0.767 . . . . 6.4000000000000004 110.166 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -61.79 -33.34 73.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.089 -0.505 . . . . 4.3300000000000001 111.853 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -65.91 -43.43 88.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.238 0.542 . . . . 6.9900000000000002 109.628 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.53 -36.99 65.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.701 -0.681 . . . . 7.4800000000000004 109.6 179.211 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -59.28 -47.02 86.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.834 -0.621 . . . . 3.8399999999999999 110.529 179.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -60.23 -46.31 90.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.154 -0.475 . . . . 3.7999999999999998 110.436 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 61.3 m -65.38 -29.18 69.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.201 -0.454 . . . . 5.0499999999999998 111.519 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -80.69 -49.71 10.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.416 -0.356 . . . . 4.3600000000000003 111.947 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 4.2 pp -64.09 -33.03 74.84 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.927 0.343 . . . . 3.21 111.927 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 427' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -63.07 -11.03 16.79 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.772 0.656 . . . . 5.2699999999999996 112.772 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -67.05 -20.55 65.86 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.764 0.316 . . . . 5.7699999999999996 110.943 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 1.6 m . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.775 -0.631 . . . . 5.1100000000000003 110.741 179.984 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.7 ptt? . . . . . 0 N--CA 1.484 1.251 0 N-CA-C 110.463 -0.199 . . . . 1.6499999999999999 110.463 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 55.0 mm-40 -109.4 143.06 39.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.468 0.175 . . . . 2.04 110.764 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 25.0 pt -128.7 162.83 34.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.473 -0.331 . . . . 1.48 110.535 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -118.34 112.23 19.77 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.429 -0.35 . . . . 2.1699999999999999 110.921 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.1 t -98.86 114.58 37.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.298 -0.41 . . . . 1.6499999999999999 110.602 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -86.91 125.91 34.34 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.29 -0.414 . . . . 3.5099999999999998 111.132 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.17 162.15 13.49 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.045 -0.525 . . . . 2.1699999999999999 109.797 179.376 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 85.5 mt -64.56 -11.03 30.3 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 112.235 0.457 . . . . 3.0499999999999998 112.235 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.25 11.94 34.68 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.217 -0.447 . . . . 2.7000000000000002 111.077 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.16 28.27 70.47 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 121.195 -0.526 . . . . 2.6400000000000001 112.641 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -101.26 143.84 30.84 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 110.511 -0.181 . . . . 2.5600000000000001 110.511 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.6 m -107.46 105.04 14.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.055 0.455 . . . . 2.4100000000000001 110.858 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 70.9 mt -86.1 114.44 25.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.86 -0.609 . . . . 1.8300000000000001 109.891 179.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.7 m -96.33 113.69 25.3 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.739 -0.467 . . . . 2.1899999999999999 109.739 179.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.6 mt -122.64 156.63 33.92 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.97 0.414 . . . . 1.3600000000000001 111.732 -179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -101.01 119.36 38.63 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.458 -0.792 . . . . 2.3999999999999999 109.685 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.2 m -142.22 -171.86 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 116.101 -0.5 . . . . 1.25 110.042 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -152.55 156.32 33.26 Favored Pre-proline 0 C--N 1.322 -0.604 0 N-CA-C 107.903 -1.147 . . . . 1.8500000000000001 107.903 179.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo -51.89 -35.16 58.79 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 122.422 2.081 . . . . 1.78 112.003 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.8 m -75.06 8.33 2.65 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.931 0.715 . . . . 2.1200000000000001 112.931 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -92.41 147.96 22.49 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 122.187 -0.321 . . . . 1.25 110.451 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -93.96 152.04 19.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.317 -0.401 . . . . 1.77 110.652 -179.515 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 49.8 mm -58.05 -43.17 84.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.398 -0.364 . . . . 1.0600000000000001 110.411 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -57.88 -37.59 74.24 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.107 -0.497 . . . . 2.2200000000000002 110.861 179.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 56.2 t30 -72.67 -37.26 67.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.34 -0.391 . . . . 1.3300000000000001 110.594 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 92.7 t -63.51 -46.95 93.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.199 -0.455 . . . . 0.67000000000000004 110.016 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.419 ' HZ1' ' CG ' ' A' ' 52' ' ' ASP . 19.4 mtmt -64.51 -31.87 73.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.11 -0.496 . . . . 1.6899999999999999 110.72 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.62 -36.61 83.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.165 -0.47 . . . . 1.0800000000000001 110.082 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -68.7 -40.34 80.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.986 -0.552 . . . . 1.48 109.744 179.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 50.3 mt -66.67 -38.96 82.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.991 -0.55 . . . . 1.3100000000000001 109.586 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.29 -36.53 80.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.396 -0.82 . . . . 2.0899999999999999 111.922 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -72.2 -38.77 68.98 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.811 0.671 . . . . 2.0499999999999998 112.811 -178.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -87.03 -43.93 11.96 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 113.208 0.818 . . . . 2.5099999999999998 113.208 -178.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -82.67 -22.2 34.68 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.707 0.632 . . . . 2.1400000000000001 112.707 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 73.92 26.36 69.22 Favored Glycine 0 CA--C 1.517 0.197 0 C-N-CA 120.694 -0.765 . . . . 2.0099999999999998 112.279 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 80.2 mt -108.12 128.28 26.03 Favored Pre-proline 0 C--N 1.326 -0.449 0 N-CA-C 110.106 -0.331 . . . . 1.8300000000000001 110.106 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -55.21 132.78 54.31 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.908 2.405 . . . . 2.04 111.999 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -57.91 -22.59 55.14 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 123.031 2.487 . . . . 1.52 112.92 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.62 -29.56 67.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.766 0.317 . . . . 2.9500000000000002 111.412 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -94.16 -3.79 50.3 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.288 -0.414 . . . . 2.73 110.534 -179.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -86.48 107.89 18.28 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.959 -0.564 . . . . 1.4399999999999999 111.5 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 12.0 mmt85 -109.76 109.01 19.57 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.221 -0.659 . . . . 2.9399999999999999 109.221 178.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 30.9 mt -87.07 136.61 32.86 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.016 0.436 . . . . 1.02 112.159 -179.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.1 mt -122.41 145.09 29.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.688 -0.687 . . . . 2.1400000000000001 110.298 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -133.92 97.33 3.86 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.952 -0.567 . . . . 1.71 109.507 178.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 61.35 40.98 13.6 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.764 -0.653 . . . . 2.1000000000000001 111.99 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.12 -5.94 84.17 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 120.949 -0.643 . . . . 1.8400000000000001 113.775 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -103.36 136.27 43.42 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.858 0.329 . . . . 3.4300000000000002 110.545 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -78.61 136.42 37.5 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.618 0.247 . . . . 2.7200000000000002 110.408 179.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 71.4 mt -93.88 137.25 33.31 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.916 0.389 . . . . 1.1699999999999999 111.383 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -87.9 132.21 34.29 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.116 -0.493 . . . . 2.6499999999999999 109.731 179.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.419 ' CG ' ' HZ1' ' A' ' 27' ' ' LYS . 4.1 m-20 -59.37 -32.07 69.79 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 112.906 0.706 . . . . 1.8300000000000001 112.906 -179.106 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -87.71 33.12 4.03 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.762 -0.732 . . . . 1.8200000000000001 113.697 -179.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.4 mmt180 -131.46 171.33 13.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.809 0.337 . . . . 2.9300000000000002 110.339 179.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 67.6 p -109.09 168.61 9.24 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.285 -0.635 . . . . 1.71 109.285 179.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 65.8 mt -66.88 -29.23 69.08 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.98 0.419 . . . . 1.49 110.139 179.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.78 -25.87 65.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.959 -0.564 . . . . 2.1000000000000001 111.226 179.303 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -62.99 -26.76 69.01 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.39 -0.368 . . . . 2.0299999999999998 111.658 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -112.7 9.03 19.17 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.26 -0.427 . . . . 1.76 109.999 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 58.24 39.39 25.77 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.436 -0.802 . . . . 3.3700000000000001 111.314 -179.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 78.0 mt -76.0 109.94 10.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.807 -0.633 . . . . 1.6499999999999999 110.046 179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -99.0 -172.42 2.28 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.85 -0.614 . . . . 2.79 111.186 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -68.6 151.01 47.32 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.246 -0.434 . . . . 3.52 112.077 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 65.54 22.08 11.78 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.367 -0.833 . . . . 3.1200000000000001 112.98 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.3 m -87.83 145.7 25.95 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.741 0.305 . . . . 1.8999999999999999 110.299 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.2 m -95.36 128.51 42.27 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.145 -0.479 . . . . 2.1600000000000001 111.597 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.8 mp -119.48 143.59 47.45 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.422 -0.955 . . . . 1.4199999999999999 108.422 178.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 46.9 m80 -105.33 149.22 26.25 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 120.534 0.207 . . . . 3.1499999999999999 110.729 -179.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 54.8 tp -126.76 111.09 13.83 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.064 0.459 . . . . 1.54 111.512 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 4.5 t -101.09 129.4 52.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.978 -0.555 . . . . 1.79 110.076 178.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.8 mt -86.18 97.14 10.18 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.063 -0.517 . . . . 2.4300000000000002 109.649 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 55.3 ttt-85 -89.62 106.28 18.35 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.098 0.475 . . . . 3.5 111.17 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 57.1 mt -84.75 -169.22 2.53 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.738 -0.664 . . . . 2.9900000000000002 110.207 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 -120.33 102.35 8.42 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 110.012 -0.366 . . . . 3.9199999999999999 110.012 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 132.83 -149.78 19.62 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.788 -0.72 . . . . 3.0800000000000001 112.291 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.086 0 CA-C-O 118.941 -0.921 . . . . 3.8199999999999998 111.602 -179.813 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.567 0 N-CA-C 111.859 -0.496 . . . . 5.9900000000000002 111.859 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 1.6 m -83.59 53.94 2.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.185 0.517 . . . . 5.7999999999999998 110.885 -179.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -87.27 76.1 9.21 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.079 -0.51 . . . . 4.29 110.764 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.97 -13.99 60.58 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.001 -0.545 . . . . 4.2199999999999998 111.12 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -106.61 107.37 60.05 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 2.5499999999999998 110.095 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -66.14 125.74 14.6 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.894 2.396 . . . . 3.77 111.419 179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -52.68 -49.39 65.37 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 112.499 0.555 . . . . 5.3600000000000003 112.499 -178.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -53.55 -52.87 58.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 6.8899999999999997 111.655 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.08 -36.55 83.48 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.622 0.601 . . . . 4.2000000000000002 112.622 -178.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 395' ' ' ILE . . . . . . . . . . . . . 89.1 mt -58.3 -48.84 83.83 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 N-CA-C 109.585 -0.524 . . . . 3.7999999999999998 109.585 178.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -62.98 -40.14 96.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.603 -0.726 . . . . 6.5800000000000001 110.641 179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -62.5 -47.7 82.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.16 -0.473 . . . . 7.46 110.983 179.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 95.4 mt -64.8 -41.97 95.4 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.354 -0.384 . . . . 4.3099999999999996 111.548 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 57.7 mtp -69.55 -31.6 69.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.895 0.379 . . . . 5.7999999999999998 111.406 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -66.01 -18.84 65.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.943 -0.571 . . . . 7.71 111.381 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 16.8 mt -78.51 2.28 19.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.971 -0.559 . . . . 5.6900000000000004 110.933 179.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 93.2 41.12 4.65 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.927 -0.654 . . . . 5.8700000000000001 111.844 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -132.1 146.18 60.57 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 120.524 0.202 . . . . 4.8399999999999999 110.462 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -79.43 164.2 24.04 Favored 'Trans proline' 0 C--O 1.234 0.276 0 C-N-CA 122.479 2.119 . . . . 4.7199999999999998 111.638 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 14.5 ttt85 -64.91 -29.21 70.14 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.337 -0.392 . . . . 4.4400000000000004 110.809 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -58.51 -44.12 89.38 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.819 -0.628 . . . . 4.6900000000000004 110.978 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -66.34 -38.48 87.74 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.656 -0.702 . . . . 3.2599999999999998 110.476 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 67.9 t -64.01 -50.98 74.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.636 -0.711 . . . . 2.1600000000000001 110.985 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 86.2 t -56.99 -51.1 73.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 112.219 0.451 . . . . 2.8900000000000001 112.219 -179.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 78.9 mttt -64.68 -44.68 89.57 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 112.254 0.465 . . . . 5.5 112.254 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -65.09 -38.43 90.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.841 0.353 . . . . 2.96 110.587 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.71 -35.99 73.01 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.059 -0.519 . . . . 3.4500000000000002 110.476 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? -60.23 -38.16 82.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.062 -0.517 . . . . 5.8499999999999996 111.674 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -87.4 -7.43 57.72 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.962 0.727 . . . . 5.5300000000000002 112.962 -179.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 16.2 p -108.46 -30.56 8.22 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.214 0.45 . . . . 5.4199999999999999 112.214 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 70.09 63.56 0.23 Allowed 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 114.123 1.157 . . . . 6.6399999999999997 114.123 179.025 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 89.67 -26.78 8.79 Favored Glycine 0 C--N 1.32 -0.313 0 N-CA-C 115.569 0.988 . . . . 4.3300000000000001 115.569 176.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -80.05 80.3 6.48 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 118.197 0.998 . . . . 6.4000000000000004 110.361 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -59.78 -27.05 66.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.98 -1.009 . . . . 4.3300000000000001 112.125 -178.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -62.46 -41.73 98.97 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.238 -1.023 . . . . 6.9900000000000002 108.238 178.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 44.7 m-85 -76.98 -30.69 56.07 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.243 -0.89 . . . . 7.4800000000000004 109.319 178.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -62.95 -43.81 97.78 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.935 -0.575 . . . . 3.8399999999999999 109.715 178.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -63.89 -39.23 93.7 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.15 -0.685 . . . . 3.7999999999999998 109.15 178.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 50.9 m -62.95 -30.89 71.92 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.623 -0.717 . . . . 5.0499999999999998 110.373 178.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -81.18 -49.62 10.58 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 115.808 -0.633 . . . . 4.3600000000000003 111.77 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 4.4 pp -64.22 -33.72 76.44 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.728 0.64 . . . . 3.21 112.728 -179.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 427' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -75.86 -1.4 25.11 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 113.878 1.066 . . . . 5.2699999999999996 113.878 -178.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -89.7 11.31 20.27 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.105 0.479 . . . . 5.7699999999999996 111.258 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 C--O 1.248 1.025 0 CA-C-N 116.054 -0.521 . . . . 5.1100000000000003 110.61 179.546 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ptt? . . . . . 0 N--CA 1.481 1.076 0 CA-C-O 120.618 0.246 . . . . 1.6499999999999999 110.664 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 75.3 mm-40 -99.28 134.4 42.19 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.763 0.316 . . . . 2.04 110.908 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 23.3 pt -127.53 155.8 38.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.315 -0.402 . . . . 1.48 110.087 178.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -116.9 124.56 49.75 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.404 -0.362 . . . . 2.1699999999999999 110.454 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.3 t -111.21 123.49 67.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 110.108 -0.33 . . . . 1.6499999999999999 110.108 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -104.31 139.95 38.56 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.446 -0.343 . . . . 3.5099999999999998 110.922 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.4 p -107.26 174.21 5.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.345 -0.388 . . . . 2.1699999999999999 110.79 179.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.2 mt -58.81 -33.55 70.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.86 -0.609 . . . . 3.0499999999999998 112.086 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.91 -3.2 47.08 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.039 0.385 . . . . 2.7000000000000002 112.039 -179.118 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.91 8.17 69.75 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.755 -0.736 . . . . 2.6400000000000001 112.252 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -79.66 121.96 25.94 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.72 -0.474 . . . . 2.5600000000000001 109.72 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.8 m -103.65 128.12 51.01 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.917 0.389 . . . . 2.4100000000000001 111.185 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 18.4 mt -115.17 143.41 25.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 109.685 -0.487 . . . . 1.8300000000000001 109.685 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.5 m -111.96 125.6 54.24 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.652 0.263 . . . . 2.1899999999999999 110.306 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.8 mp -127.01 142.57 51.52 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.277 -0.419 . . . . 1.3600000000000001 110.916 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -99.19 106.2 18.33 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 116.078 -0.51 . . . . 2.3999999999999999 109.967 179.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 7.0 m -134.16 164.08 35.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 109.307 -0.627 . . . . 1.25 109.307 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -104.92 155.34 37.72 Favored Pre-proline 0 C--N 1.32 -0.689 0 C-N-CA 121.106 -0.238 . . . . 1.8500000000000001 110.439 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_exo -58.12 -17.43 31.76 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.991 2.461 . . . . 1.78 113.008 -179.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.1 -1.75 58.24 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.514 -0.312 . . . . 2.1200000000000001 111.804 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -79.32 142.56 35.98 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.902 0.382 . . . . 1.25 111.032 -179.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.6 m -81.59 146.79 29.93 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.784 -0.644 . . . . 1.77 110.269 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 43.0 mm -53.07 -44.97 52.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 O-C-N 123.202 0.314 . . . . 1.0600000000000001 111.585 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -58.35 -41.22 84.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.481 -0.327 . . . . 2.2200000000000002 111.527 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -63.45 -36.42 83.7 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.992 0.425 . . . . 1.3300000000000001 110.383 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 58.1 t -67.1 -42.61 88.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.989 -0.55 . . . . 0.67000000000000004 109.572 178.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 27.3 mtmt -63.31 -37.38 87.04 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.207 -0.451 . . . . 1.6899999999999999 110.37 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.86 -37.38 84.31 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.097 -0.501 . . . . 1.0800000000000001 109.844 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -68.49 -34.21 75.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.793 -0.639 . . . . 1.48 110.143 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 70.9 mt -70.63 -32.85 50.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 108.97 -0.752 . . . . 1.3100000000000001 108.97 178.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -66.31 -32.89 74.57 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.484 -0.78 . . . . 2.0899999999999999 109.383 178.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -71.79 -42.92 66.52 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.456 -0.793 . . . . 2.0499999999999998 109.705 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -66.82 -59.66 3.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.675 -0.693 . . . . 2.5099999999999998 112.186 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -92.0 -65.27 1.02 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.197 -0.456 . . . . 2.1400000000000001 112.179 -178.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 133.54 0.72 4.0 Favored Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.323 -0.941 . . . . 2.0099999999999998 112.652 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 16.7 mt -67.83 125.1 90.91 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 110.144 -0.317 . . . . 1.8300000000000001 110.144 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -54.84 135.89 69.77 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.73 2.286 . . . . 2.04 111.423 179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -51.54 -30.58 36.29 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 123.271 2.647 . . . . 1.52 113.438 -179.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -70.16 -29.69 66.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.162 0.506 . . . . 2.9500000000000002 111.584 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -89.0 -4.46 58.42 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.342 -0.39 . . . . 2.73 110.289 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -92.85 111.82 23.56 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.797 -0.638 . . . . 1.4399999999999999 111.173 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -125.07 104.3 8.47 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 108.618 -0.882 . . . . 2.9399999999999999 108.618 178.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 82.8 mt -81.99 138.09 34.98 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.9 0.704 . . . . 1.02 112.9 -178.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 65.8 mt -124.09 134.96 65.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.265 -0.88 . . . . 2.1400000000000001 109.732 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -124.19 107.16 10.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.446 -0.343 . . . . 1.71 110.274 179.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.33 35.1 23.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.882 -0.599 . . . . 2.1000000000000001 112.108 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.71 -13.48 67.38 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 120.909 -0.662 . . . . 1.8400000000000001 112.924 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.3 mttt -90.44 142.12 28.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.657 0.228 . . . . 3.4300000000000002 110.807 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -83.61 135.76 34.49 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 110.025 -0.361 . . . . 2.7200000000000002 110.025 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 40.7 mt -97.58 135.85 38.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.717 0.294 . . . . 1.1699999999999999 110.943 -179.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -96.51 138.48 34.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.007 0.432 . . . . 2.6499999999999999 111.078 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.25 -26.49 66.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.63 -0.713 . . . . 1.8300000000000001 112.527 -179.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -87.75 11.21 67.2 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.736 -0.745 . . . . 1.8200000000000001 114.043 -178.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 41.9 mmt-85 -117.79 164.07 15.56 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 117.26 0.53 . . . . 2.9300000000000002 111.11 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 61.1 p -102.05 171.83 7.27 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.175 -0.466 . . . . 1.71 110.202 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 84.0 mt -63.95 -33.72 76.36 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.105 0.479 . . . . 1.49 110.528 179.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 67.4 m -70.03 -23.94 63.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.921 -0.581 . . . . 2.1000000000000001 111.332 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -67.25 -20.21 65.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.397 -0.365 . . . . 2.0299999999999998 111.758 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -114.66 12.57 17.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.105 -0.498 . . . . 1.76 110.735 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.0 m-20 58.49 37.86 25.56 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.667 -0.697 . . . . 3.3700000000000001 111.625 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 86.9 mt -82.76 120.5 34.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.123 -0.49 . . . . 1.6499999999999999 110.112 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -106.33 -167.69 1.33 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.943 -0.571 . . . . 2.79 109.975 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 10.0 pttp -76.45 150.79 36.66 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 121.116 -0.233 . . . . 3.52 110.629 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 70.99 14.16 6.87 Favored 'General case' 0 C--O 1.235 0.29 0 O-C-N 123.654 0.597 . . . . 3.1200000000000001 112.155 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 35.5 m -79.0 149.66 32.16 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.301 -0.409 . . . . 1.8999999999999999 109.976 178.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -105.04 124.69 49.97 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.117 -0.492 . . . . 2.1600000000000001 111.059 -179.24 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.0 mp -110.8 138.5 47.12 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.993 -0.743 . . . . 1.4199999999999999 108.993 179.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 65.3 m80 -103.31 136.96 42.1 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.711 0.291 . . . . 3.1499999999999999 111.587 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 48.5 tp -123.59 102.3 7.78 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.993 -0.548 . . . . 1.54 109.96 179.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 16.5 t -92.21 135.65 26.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.041 -0.527 . . . . 1.79 109.792 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 65.6 mt -83.22 124.62 30.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.374 -0.375 . . . . 2.4300000000000002 111.452 -179.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 38.1 ttt180 -118.67 99.11 6.58 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.891 -0.595 . . . . 3.5 110.836 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 89.0 mt -72.42 167.44 20.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.025 -0.534 . . . . 2.9900000000000002 110.457 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -103.37 -27.38 12.48 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.859 0.361 . . . . 3.9199999999999999 111.204 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -164.36 179.46 39.15 Favored Glycine 0 N--CA 1.446 -0.679 0 N-CA-C 111.307 -0.717 . . . . 3.0800000000000001 111.307 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.89 0 CA-C-O 118.82 -0.989 . . . . 3.8199999999999998 111.712 179.892 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.825 0 N-CA-C 111.904 -0.478 . . . . 5.9900000000000002 111.904 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.55 81.29 7.69 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.06 0.457 . . . . 5.7999999999999998 110.928 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -121.51 86.95 2.66 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.052 0.453 . . . . 4.29 110.391 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.2 m -73.69 -16.19 61.21 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.84 -0.618 . . . . 4.2199999999999998 110.671 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -111.2 102.04 51.89 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-N 116.059 -0.519 . . . . 2.5499999999999998 109.931 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo -64.91 132.42 32.3 Favored 'Trans proline' 0 C--O 1.236 0.404 0 C-N-CA 122.667 2.244 . . . . 3.77 111.606 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -51.77 -45.26 63.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.734 -0.666 . . . . 5.3600000000000003 112.678 -178.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -54.5 -48.62 71.66 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.235 0.457 . . . . 6.8899999999999997 112.235 -179.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.54 -39.17 93.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.286 -0.416 . . . . 4.2000000000000002 110.898 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 395' ' ' ILE . . . . . . . . . . . . . 83.0 mt -62.73 -42.0 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.117 0 CA-C-N 116.19 -0.459 . . . . 3.7999999999999998 110.197 179.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -57.18 -43.71 82.9 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.186 -0.461 . . . . 6.5800000000000001 111.382 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 8.8 tp60 -65.8 -41.6 91.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.021 0.438 . . . . 7.46 110.808 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 92.8 mt -67.74 -34.94 77.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 4.3099999999999996 111.908 -179.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 31.5 mmt -67.27 -33.78 76.04 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.979 0.418 . . . . 5.7999999999999998 110.172 179.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -61.58 -27.2 68.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.527 -0.76 . . . . 7.71 111.697 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 30.9 mt -74.3 -6.45 48.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.12 -0.491 . . . . 5.6900000000000004 112.155 -179.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 85.53 46.36 5.51 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.609 -0.805 . . . . 5.8700000000000001 112.384 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -125.64 156.98 70.03 Favored Pre-proline 0 C--N 1.329 -0.285 0 C-N-CA 122.205 0.202 . . . . 4.8399999999999999 110.577 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -84.65 146.31 10.63 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.864 2.376 . . . . 4.7199999999999998 111.084 178.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 37.4 ttt180 -63.58 -32.24 73.64 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.784 0.29 . . . . 4.4400000000000004 111.784 -179.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -57.24 -40.07 76.85 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.154 0.502 . . . . 4.6900000000000004 110.719 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -69.79 -36.69 75.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.759 -0.655 . . . . 3.2599999999999998 109.931 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 49.7 t -63.24 -44.11 99.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.655 -0.702 . . . . 2.1600000000000001 110.272 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 74.1 t -56.52 -49.09 79.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.002 -0.544 . . . . 2.8900000000000001 109.877 179.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 51.4 mttp -63.82 -47.99 78.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.789 -0.641 . . . . 5.5 110.822 179.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -57.32 -51.04 71.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.807 -0.633 . . . . 2.96 112.563 -178.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 5.2 mp -68.78 -31.33 70.28 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.459 0.541 . . . . 3.4500000000000002 112.459 -179.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 8.8 mmtt -69.29 -41.56 76.66 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.083 0.401 . . . . 5.8499999999999996 112.083 -179.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 23.9 pt20 -81.15 -8.57 59.79 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.7 0.63 . . . . 5.5300000000000002 112.7 -179.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 40.9 p -113.3 -4.83 13.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.792 0.329 . . . . 5.4199999999999999 110.961 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 56.3 m-20 63.59 58.25 1.34 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.756 -0.656 . . . . 6.6399999999999997 111.933 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 69.69 8.25 59.98 Favored Glycine 0 C--O 1.229 -0.178 0 CA-C-N 115.616 -0.72 . . . . 4.3300000000000001 114.089 178.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 -76.99 82.98 3.51 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 122.324 -0.515 . . . . 6.4000000000000004 109.734 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -48.16 -47.8 34.77 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 113.61 0.967 . . . . 4.3300000000000001 113.61 -178.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 4.1 pm0 -65.48 -43.36 90.48 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.813 0.34 . . . . 6.9900000000000002 111.889 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -69.23 -35.47 76.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.148 0.499 . . . . 7.4800000000000004 110.0 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -65.51 -37.51 87.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.47 -0.786 . . . . 3.8399999999999999 110.397 179.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -60.2 -43.36 95.98 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.052 0.454 . . . . 3.7999999999999998 109.991 179.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 65.8 m -74.85 -38.59 61.95 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.958 -0.565 . . . . 5.0499999999999998 111.514 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.5 -46.23 80.51 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.584 -0.28 . . . . 4.3600000000000003 111.529 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.58 -33.22 72.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.351 -0.386 . . . . 3.21 111.249 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 427' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -70.93 -0.94 10.34 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.332 0.493 . . . . 5.2699999999999996 112.332 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -70.29 -6.02 31.98 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.089 0.471 . . . . 5.7699999999999996 110.996 178.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 30.0 m . . . . . 0 C--O 1.246 0.916 0 CA-C-O 118.692 -0.671 . . . . 5.1100000000000003 109.871 179.036 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 ptt? . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 110.048 -0.352 . . . . 1.6499999999999999 110.048 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 75.2 mm-40 -103.84 133.47 48.76 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.616 0.246 . . . . 2.04 110.986 -179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 23.5 pt -129.3 169.34 20.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.31 -0.405 . . . . 1.48 110.04 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -125.45 135.15 52.04 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.423 -0.353 . . . . 2.1699999999999999 110.23 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.8 t -118.18 120.58 64.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.555 -0.293 . . . . 1.6499999999999999 110.348 179.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.0 mtmt -96.94 128.6 44.06 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.25 0.547 . . . . 3.5099999999999998 111.48 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.06 160.07 14.55 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.655 -0.702 . . . . 2.1699999999999999 110.126 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.16 -28.16 67.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.78 0.324 . . . . 3.0499999999999998 111.447 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.26 29.84 0.22 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.384 -0.371 . . . . 2.7000000000000002 111.742 -179.597 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 51.66 46.49 53.78 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 121.416 -0.421 . . . . 2.6400000000000001 112.75 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -126.77 153.67 45.26 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 110.128 -0.323 . . . . 2.5600000000000001 110.128 -179.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.1 m -128.17 121.42 29.44 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.014 0.435 . . . . 2.4100000000000001 110.725 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 5.4 mt -106.02 140.06 25.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.03 -0.532 . . . . 1.8300000000000001 110.544 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.73 135.3 35.17 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.124 -0.324 . . . . 2.1899999999999999 110.124 179.37 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 34.9 mt -135.3 137.46 42.48 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.946 0.403 . . . . 1.3600000000000001 111.522 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -105.66 106.77 17.43 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.691 -0.686 . . . . 2.3999999999999999 109.229 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 4.2 m -138.98 178.19 4.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.176 -0.466 . . . . 1.25 110.713 -179.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -127.13 155.75 75.58 Favored Pre-proline 0 C--N 1.32 -0.682 0 N-CA-C 109.442 -0.577 . . . . 1.8500000000000001 109.442 179.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_exo -52.34 -29.95 40.93 Favored 'Trans proline' 0 CA--C 1.532 0.378 0 C-N-CA 122.745 2.297 . . . . 1.78 113.017 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.23 -4.37 50.33 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.399 0.518 . . . . 2.1200000000000001 112.399 -179.524 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.87 135.64 40.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.743 0.306 . . . . 1.25 110.517 -179.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.91 145.21 31.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.065 -0.516 . . . . 1.77 110.261 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 46.6 mm -55.09 -43.76 71.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 O-C-N 123.111 0.257 . . . . 1.0600000000000001 111.225 -179.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -58.63 -38.93 79.13 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.318 -0.401 . . . . 2.2200000000000002 110.826 179.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -69.38 -37.34 77.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.244 -0.434 . . . . 1.3300000000000001 109.939 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 97.3 t -62.23 -42.71 96.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.966 -0.561 . . . . 0.67000000000000004 109.826 179.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.3 mtmt -62.81 -34.78 78.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.033 -0.53 . . . . 1.6899999999999999 110.815 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.56 -38.76 92.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.037 0.446 . . . . 1.0800000000000001 109.81 178.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 48.7 mttt -67.57 -32.5 73.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.864 -0.607 . . . . 1.48 110.069 179.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 69.4 mt -69.09 -35.6 69.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.091 -0.504 . . . . 1.3100000000000001 109.75 179.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -65.7 -31.98 73.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.176 -0.465 . . . . 2.0899999999999999 110.126 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -74.79 -2.5 26.89 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.848 -0.615 . . . . 2.0499999999999998 110.82 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -121.96 -45.15 2.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.305 -0.407 . . . . 2.5099999999999998 112.014 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -92.63 -21.84 19.81 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.271 0.471 . . . . 2.1400000000000001 112.271 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.34 19.39 78.34 Favored Glycine 0 CA--C 1.518 0.256 0 C-N-CA 120.57 -0.824 . . . . 2.0099999999999998 112.115 -179.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 44.6 mt -104.49 125.73 33.31 Favored Pre-proline 0 C--N 1.327 -0.404 0 N-CA-C 110.337 -0.246 . . . . 1.8300000000000001 110.337 -179.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -57.8 140.96 95.44 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.835 2.357 . . . . 2.04 112.044 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -60.11 -18.66 52.44 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 123.126 2.551 . . . . 1.52 112.253 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -63.61 -31.71 72.96 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.835 -0.621 . . . . 2.9500000000000002 110.843 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -102.61 -0.59 31.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.074 -0.512 . . . . 2.73 110.779 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 56.3 mt-30 -87.21 120.49 28.55 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.084 -0.507 . . . . 1.4399999999999999 111.818 -178.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 40.8 mtt180 -126.29 124.09 39.55 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.025 -0.731 . . . . 2.9399999999999999 109.025 178.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 85.1 mt -108.92 129.06 55.42 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.898 0.38 . . . . 1.02 111.022 -179.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -120.67 144.73 28.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 116.062 -0.517 . . . . 2.1400000000000001 110.366 179.202 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -129.64 101.98 6.15 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.887 -0.783 . . . . 1.71 108.887 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.69 34.31 22.09 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.993 -0.549 . . . . 2.1000000000000001 110.921 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.74 -9.72 76.85 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 121.038 -0.601 . . . . 1.8400000000000001 113.358 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -88.72 134.19 33.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.892 0.346 . . . . 3.4300000000000002 111.522 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -74.82 120.1 19.9 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.512 -0.767 . . . . 2.7200000000000002 111.232 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.1 mt -86.33 110.58 19.76 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.918 -0.401 . . . . 1.1699999999999999 109.918 179.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -74.67 135.74 41.91 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.219 -0.446 . . . . 2.6499999999999999 111.308 -179.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -59.93 -31.48 69.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.673 -0.694 . . . . 1.8300000000000001 111.624 -179.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.93 7.43 62.99 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.924 -0.58 . . . . 1.8200000000000001 113.4 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 17.7 mmt-85 -115.03 167.74 10.54 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 122.577 -0.366 . . . . 2.9300000000000002 110.257 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 42.3 p -110.12 176.82 4.91 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.768 0.318 . . . . 1.71 110.615 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 80.4 mt -65.62 -36.64 84.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.282 -0.417 . . . . 1.49 111.785 -179.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.51 -25.09 66.52 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 111.912 0.338 . . . . 2.1000000000000001 111.912 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -62.46 -34.8 77.54 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.887 0.375 . . . . 2.0299999999999998 111.126 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -103.87 15.08 29.49 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.006 -0.543 . . . . 1.76 111.518 -179.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 59.45 40.07 21.17 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.436 0.636 . . . . 3.3700000000000001 111.689 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 92.8 mt -83.11 121.66 36.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.929 -0.578 . . . . 1.6499999999999999 109.883 179.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -114.94 -166.23 1.09 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.852 -0.613 . . . . 2.79 110.558 -179.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 42.6 pttt -70.09 148.3 48.93 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.493 -0.321 . . . . 3.52 111.515 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 70.96 0.13 3.27 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 113.149 0.796 . . . . 3.1200000000000001 113.149 179.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 16.7 m -65.31 140.8 58.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.837 0.351 . . . . 1.8999999999999999 110.393 179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.5 m -104.33 126.92 51.85 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.022 0.439 . . . . 2.1600000000000001 111.501 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.4 mp -108.0 146.35 32.62 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.801 -0.814 . . . . 1.4199999999999999 108.801 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 44.4 m80 -105.43 134.93 47.74 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.701 0.286 . . . . 3.1499999999999999 110.845 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 36.4 tp -119.76 115.72 24.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.131 -0.486 . . . . 1.54 111.394 -179.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 9.1 t -120.18 129.27 75.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.947 -0.569 . . . . 1.79 109.623 178.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 58.5 mt -71.5 126.48 29.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.101 -0.499 . . . . 2.4300000000000002 110.916 -179.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.5 92.63 7.65 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.886 -0.597 . . . . 3.5 110.508 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 84.1 mt -77.72 128.77 34.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.276 -0.42 . . . . 2.9900000000000002 110.799 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.4 mmm180 -98.56 -44.92 6.28 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.2 -0.455 . . . . 3.9199999999999999 110.401 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -94.21 91.04 1.4 Allowed Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.685 -0.769 . . . . 3.0800000000000001 111.799 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.438 -1.201 . . . . 3.8199999999999998 111.456 -179.851 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.762 0 N-CA-C 112.072 -0.411 . . . . 5.9900000000000002 112.072 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.65 87.03 7.34 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.123 0.487 . . . . 5.7999999999999998 110.526 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -87.39 82.82 7.44 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.066 -0.515 . . . . 4.29 111.223 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.09 -25.35 63.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.911 -0.586 . . . . 4.2199999999999998 110.67 179.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -119.27 110.71 37.39 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.826 -0.625 . . . . 2.5499999999999998 110.824 -179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -65.35 146.92 86.94 Favored 'Trans proline' 0 C--O 1.234 0.313 0 C-N-CA 122.924 2.416 . . . . 3.77 112.13 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.23 -56.55 13.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.488 -0.778 . . . . 5.3600000000000003 112.917 -178.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -61.51 -43.79 98.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.268 -0.424 . . . . 6.8899999999999997 111.682 -179.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 22.3 m -55.61 -48.6 74.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.976 -0.556 . . . . 4.2000000000000002 111.439 -179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 395' ' ' ILE . . . . . . . . . . . . . 84.0 mt -61.62 -50.05 81.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.856 0.36 . . . . 3.7999999999999998 110.266 179.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -56.6 -45.43 81.42 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.981 0.734 . . . . 6.5800000000000001 112.981 -178.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.58 -33.2 75.36 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.871 -0.331 . . . . 7.46 111.519 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 84.6 mt -78.74 -25.25 44.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.849 0.356 . . . . 4.3099999999999996 111.268 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 31.7 mmt -73.92 -24.87 59.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.072 0.463 . . . . 5.7999999999999998 109.891 179.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -61.27 -30.19 70.31 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.516 -0.765 . . . . 7.71 111.366 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 9.8 mt -65.4 -15.35 62.5 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.955 -0.566 . . . . 5.6900000000000004 111.443 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 98.0 39.25 3.86 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.735 -0.745 . . . . 5.8700000000000001 112.082 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -120.12 154.84 56.02 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-O 120.413 0.149 . . . . 4.8399999999999999 110.714 -179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -78.79 158.19 27.87 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.526 2.151 . . . . 4.7199999999999998 112.386 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 11.4 ttt85 -63.8 -32.01 73.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.834 -0.621 . . . . 4.4400000000000004 110.838 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -61.46 -40.3 94.03 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.956 0.408 . . . . 4.6900000000000004 110.54 179.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -65.77 -39.01 90.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.77 -0.65 . . . . 3.2599999999999998 111.37 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 1.4 p -66.44 -35.03 73.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 C-N-CA 120.896 -0.322 . . . . 2.1600000000000001 111.367 -179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 84.8 t -67.14 -44.62 87.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.99 0.424 . . . . 2.8900000000000001 109.892 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -62.96 -47.06 84.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.812 -0.631 . . . . 5.5 110.587 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -63.94 -45.83 87.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.894 -0.594 . . . . 2.96 110.859 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.77 -51.44 69.73 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.432 0.531 . . . . 3.4500000000000002 112.432 -179.262 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 5.9 mtpm? -60.51 -31.47 70.54 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.459 0.541 . . . . 5.8499999999999996 112.459 -179.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -87.86 -18.85 28.32 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 113.362 0.875 . . . . 5.5300000000000002 113.362 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 35.0 p -107.62 3.99 25.4 Favored 'General case' 0 C--O 1.236 0.36 0 O-C-N 121.858 -0.526 . . . . 5.4199999999999999 111.77 -178.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 67.71 50.83 0.85 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.869 -0.605 . . . . 6.6399999999999997 111.202 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 66.15 -27.33 0.16 Allowed Glycine 0 CA--C 1.528 0.848 0 N-CA-C 117.373 1.709 . . . . 4.3300000000000001 117.373 176.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -58.9 113.98 2.33 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 118.588 1.194 . . . . 6.4000000000000004 113.199 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -61.02 -26.01 67.3 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.33 -0.85 . . . . 4.3300000000000001 113.252 -178.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -59.24 -56.35 23.29 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.585 0.707 . . . . 6.9900000000000002 110.667 -179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -74.95 -29.79 61.03 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.769 -0.65 . . . . 7.4800000000000004 110.43 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -60.47 -48.53 81.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.702 -0.681 . . . . 3.8399999999999999 110.193 179.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -62.81 -38.78 92.06 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.873 -0.603 . . . . 3.7999999999999998 110.006 179.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 69.0 m -64.28 -31.53 72.77 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.038 -0.528 . . . . 5.0499999999999998 110.731 178.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -81.9 -48.94 10.91 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 112.903 0.705 . . . . 4.3600000000000003 112.903 -179.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.5 pp -64.02 -33.21 75.22 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.768 0.655 . . . . 3.21 112.768 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 427' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -69.3 -1.24 7.64 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 113.893 1.071 . . . . 5.2699999999999996 113.893 -179.052 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -113.89 23.45 13.0 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.499 0.555 . . . . 5.7699999999999996 112.499 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 13.3 m . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.584 -0.722 . . . . 5.1100000000000003 110.302 179.526 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ptt? . . . . . 0 N--CA 1.482 1.152 0 N-CA-C 110.179 -0.304 . . . . 1.6499999999999999 110.179 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 46.0 mm-40 -107.84 142.62 37.63 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.583 0.23 . . . . 2.04 110.796 -179.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 18.1 pt -130.89 153.75 39.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.399 -0.364 . . . . 1.48 110.258 179.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -105.16 119.54 39.3 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.544 -0.298 . . . . 2.1699999999999999 110.597 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.3 t -103.16 119.35 51.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 110.027 -0.36 . . . . 1.6499999999999999 110.027 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -103.12 131.74 49.91 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.266 -0.424 . . . . 3.5099999999999998 110.983 -179.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.71 161.5 13.57 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.139 -0.482 . . . . 2.1699999999999999 109.877 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 78.0 mt -59.39 -23.6 62.74 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.258 0.466 . . . . 3.0499999999999998 112.258 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -79.91 -8.08 59.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.98 0.419 . . . . 2.7000000000000002 111.699 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.12 3.01 57.97 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.765 -0.731 . . . . 2.6400000000000001 111.968 -179.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -75.44 146.47 40.69 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.457 -0.571 . . . . 2.5600000000000001 109.457 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.2 m -139.26 119.71 13.92 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.726 0.298 . . . . 2.4100000000000001 110.897 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 24.4 pt -119.33 148.83 22.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.537 -0.301 . . . . 1.8300000000000001 110.818 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 6.6 m -103.91 111.64 24.26 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.918 0.389 . . . . 2.1899999999999999 110.391 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.5 mt -104.47 152.39 22.4 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.22 -0.445 . . . . 1.3600000000000001 111.126 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -98.96 121.23 40.65 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.882 -0.599 . . . . 2.3999999999999999 110.739 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 5.8 m -138.5 163.58 28.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 116.158 -0.474 . . . . 1.25 110.684 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -117.94 158.3 46.25 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 116.034 -0.53 . . . . 1.8500000000000001 109.778 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -58.29 -23.65 63.75 Favored 'Trans proline' 0 N--CA 1.475 0.405 0 C-N-CA 122.607 2.205 . . . . 1.78 112.388 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -92.71 3.76 55.01 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.171 -0.468 . . . . 2.1200000000000001 111.599 -179.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -77.45 130.46 37.05 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 120.833 0.349 . . . . 1.25 110.916 -179.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.22 155.23 27.46 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.131 -0.692 . . . . 1.77 109.131 178.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 43.7 mm -58.59 -38.18 69.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 120.518 0.199 . . . . 1.0600000000000001 111.347 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -60.62 -34.91 74.95 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.114 0.483 . . . . 2.2200000000000002 110.3 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -65.0 -36.14 83.45 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 115.98 -0.555 . . . . 1.3300000000000001 110.377 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 22.0 t -66.04 -38.63 82.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.076 -0.511 . . . . 0.67000000000000004 109.648 179.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 4.5 mmmm -61.0 -40.9 95.29 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.723 -0.671 . . . . 1.6899999999999999 109.948 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.67 -36.08 82.63 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.638 -0.71 . . . . 1.0800000000000001 110.588 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 87.4 mttt -68.52 -39.93 81.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.423 -0.353 . . . . 1.48 110.47 179.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 81.7 mt -66.8 -36.32 76.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 109.41 -0.589 . . . . 1.3100000000000001 109.41 178.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -66.82 -33.48 75.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.76 -0.654 . . . . 2.0899999999999999 110.038 179.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -69.41 -34.56 74.66 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.699 -0.682 . . . . 2.0499999999999998 110.821 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -84.88 -61.46 1.77 Allowed 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.581 0.585 . . . . 2.5099999999999998 112.581 -179.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -80.73 -45.94 16.29 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 113.089 0.774 . . . . 2.1400000000000001 113.089 -177.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 99.33 25.44 9.42 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.517 -0.849 . . . . 2.0099999999999998 111.576 -178.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 71.9 mt -98.62 127.66 35.1 Favored Pre-proline 0 C--N 1.326 -0.451 0 N-CA-C 109.617 -0.512 . . . . 1.8300000000000001 109.617 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_exo -50.97 133.41 40.42 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.991 2.461 . . . . 2.04 112.104 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.53 -19.68 53.42 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 123.338 2.692 . . . . 1.52 112.625 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -21.14 58.52 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.349 -0.387 . . . . 2.9500000000000002 110.92 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -98.14 -13.9 20.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.139 0.495 . . . . 2.73 110.373 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -78.84 122.83 26.57 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.809 -0.632 . . . . 1.4399999999999999 111.951 -179.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 14.1 mmt85 -121.44 107.61 12.67 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.189 -0.671 . . . . 2.9399999999999999 109.189 177.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 69.7 mt -91.87 125.47 36.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.084 -0.507 . . . . 1.02 112.309 -178.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 43.9 mt -117.23 146.18 22.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.639 -0.709 . . . . 2.1400000000000001 109.816 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -132.8 93.16 3.16 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.39 -0.368 . . . . 1.71 110.36 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 56.29 50.46 13.27 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 113.002 0.741 . . . . 2.1000000000000001 113.002 179.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.63 -38.69 3.01 Favored Glycine 0 CA--C 1.517 0.172 0 C-N-CA 120.721 -0.752 . . . . 1.8400000000000001 113.525 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -85.8 153.27 22.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.67 0.235 . . . . 3.4300000000000002 110.513 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -97.77 145.57 26.24 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.998 0.428 . . . . 2.7200000000000002 111.031 -179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 73.0 mt -89.71 122.97 33.32 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.652 -0.703 . . . . 1.1699999999999999 110.441 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -88.83 130.14 35.44 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.094 -0.503 . . . . 2.6499999999999999 110.225 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -54.69 -28.31 46.75 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.045 0.387 . . . . 1.8300000000000001 112.045 -179.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -85.38 10.86 62.65 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.918 -0.658 . . . . 1.8200000000000001 113.231 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 81.6 mmt-85 -115.75 169.92 8.84 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 117.011 0.405 . . . . 2.9300000000000002 110.866 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 25.9 p -111.61 166.16 11.39 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.773 -0.649 . . . . 1.71 109.638 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 83.7 mt -64.16 -28.45 69.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.067 0.461 . . . . 1.49 110.942 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.8 m -73.08 -19.59 61.13 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.866 -0.606 . . . . 2.1000000000000001 111.698 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -66.7 -34.22 77.36 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.103 0.478 . . . . 2.0299999999999998 110.65 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -101.69 8.95 41.41 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.807 -0.633 . . . . 1.76 109.934 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 53.37 49.71 19.12 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.653 -0.703 . . . . 3.3700000000000001 110.512 -179.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 79.8 mt -81.67 106.88 13.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.47 -0.786 . . . . 1.6499999999999999 110.003 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -84.76 177.98 7.81 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.718 -0.674 . . . . 2.79 110.399 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.87 148.66 51.64 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.199 -0.455 . . . . 3.52 110.173 179.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 74.17 8.69 4.63 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 113.065 0.765 . . . . 3.1200000000000001 113.065 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.6 m -70.94 150.35 45.8 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 122.13 -0.357 . . . . 1.8999999999999999 110.958 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.6 m -104.14 127.71 51.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.047 0.451 . . . . 2.1600000000000001 111.109 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.8 mp -111.08 145.75 38.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.669 -0.696 . . . . 1.4199999999999999 109.314 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 65.3 m80 -102.74 129.7 49.45 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.749 0.309 . . . . 3.1499999999999999 111.631 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 51.6 tp -110.12 105.68 14.86 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.945 -0.571 . . . . 1.54 110.483 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 62.6 t -98.01 137.0 26.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 115.884 -0.598 . . . . 1.79 110.424 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 66.9 mt -86.62 107.95 18.4 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.047 -0.524 . . . . 2.4300000000000002 109.625 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -104.13 95.3 5.88 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.241 -0.436 . . . . 3.5 111.037 -179.404 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 42.7 mt -80.56 161.7 24.65 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.045 -0.525 . . . . 2.9900000000000002 109.625 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.1 mmt180 -104.77 7.75 34.73 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.856 0.36 . . . . 3.9199999999999999 110.994 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -174.19 -170.68 37.76 Favored Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 111.135 -0.786 . . . . 3.0800000000000001 111.135 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.827 -0.985 . . . . 3.8199999999999998 111.507 -179.882 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.826 0 N-CA-C 111.864 -0.495 . . . . 5.9900000000000002 111.864 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 35.5 m -143.0 39.88 1.48 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.124 0.488 . . . . 5.7999999999999998 110.72 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -73.93 105.11 5.04 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.9 -0.591 . . . . 4.29 111.056 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.15 -18.72 52.62 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.956 -0.566 . . . . 4.2199999999999998 110.549 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -141.62 112.23 6.43 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.868 -0.606 . . . . 2.5499999999999998 110.721 179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -60.16 149.98 81.98 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 122.87 2.38 . . . . 3.77 112.421 179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -53.51 -46.45 70.09 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.651 -0.704 . . . . 5.3600000000000003 112.719 -179.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -54.88 -51.29 66.43 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.828 0.347 . . . . 6.8899999999999997 111.499 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -39.72 86.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.948 -0.569 . . . . 4.2000000000000002 111.736 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 395' ' ' ILE . . . . . . . . . . . . . 73.3 mt -61.71 -51.36 73.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-O 120.884 0.373 . . . . 3.7999999999999998 109.996 179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -55.12 -33.68 63.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.788 -0.642 . . . . 6.5800000000000001 112.57 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 -69.32 -53.57 18.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.941 0.4 . . . . 7.46 110.822 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 88.8 mt -67.57 -29.45 68.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.023 -0.535 . . . . 4.3099999999999996 112.3 -178.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 28.6 mmt -68.96 -27.57 65.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.62 0.248 . . . . 5.7999999999999998 111.45 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -71.45 -19.57 62.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.044 -0.525 . . . . 7.71 111.537 -179.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 47.5 mt -69.62 -26.53 64.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.231 -0.441 . . . . 5.6900000000000004 110.966 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 112.83 6.75 22.67 Favored Glycine 0 N--CA 1.453 -0.172 0 C-N-CA 120.685 -0.769 . . . . 5.8700000000000001 112.567 -179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -89.64 150.14 43.62 Favored Pre-proline 0 C--N 1.328 -0.354 0 N-CA-C 110.393 -0.225 . . . . 4.8399999999999999 110.393 179.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -72.65 156.47 53.52 Favored 'Trans proline' 0 C--O 1.236 0.393 0 C-N-CA 122.457 2.105 . . . . 4.7199999999999998 111.347 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 36.3 ttt-85 -60.65 -30.7 70.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.51 -0.314 . . . . 4.4400000000000004 111.498 -179.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -58.89 -38.69 79.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.332 -0.395 . . . . 4.6900000000000004 110.844 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -62.37 -38.56 90.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.968 -0.56 . . . . 3.2599999999999998 110.041 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 2.6 t -65.33 -43.53 94.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.898 -0.592 . . . . 2.1600000000000001 110.647 179.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 48.7 t -57.06 -49.03 80.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.248 -0.433 . . . . 2.8900000000000001 110.45 179.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 75.6 mttt -68.08 -48.0 66.72 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.94 -0.573 . . . . 5.5 111.717 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -60.75 -50.71 72.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.321 0.489 . . . . 2.96 112.321 -179.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.17 -30.83 71.78 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.466 0.543 . . . . 3.4500000000000002 112.466 -178.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 6.8 mmtt -68.84 -37.97 79.5 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 111.83 0.308 . . . . 5.8499999999999996 111.83 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 29.2 pt20 -87.68 -8.13 56.52 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 113.018 0.748 . . . . 5.5300000000000002 113.018 -179.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 25.1 p -109.22 -19.39 13.34 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 120.934 0.397 . . . . 5.4199999999999999 111.574 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 68.3 62.1 0.38 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.19 0.811 . . . . 6.6399999999999997 113.19 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 79.44 -23.34 3.47 Favored Glycine 0 CA--C 1.521 0.465 0 N-CA-C 115.547 0.979 . . . . 4.3300000000000001 115.547 177.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -65.94 103.33 0.91 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 117.585 0.692 . . . . 6.4000000000000004 110.546 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -67.13 -38.72 86.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.914 -0.585 . . . . 4.3300000000000001 111.614 -179.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -66.24 -38.74 88.6 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-O 121.299 0.571 . . . . 6.9900000000000002 110.018 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -72.92 -36.01 67.17 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.876 -0.787 . . . . 7.4800000000000004 108.876 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -62.69 -43.25 99.29 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.734 -0.666 . . . . 3.8399999999999999 110.161 178.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -61.16 -38.18 85.54 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.215 0.531 . . . . 3.7999999999999998 110.151 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 17.7 m -72.35 -34.85 68.31 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.53 -0.759 . . . . 5.0499999999999998 110.45 178.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -71.53 -46.12 60.48 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.993 -0.548 . . . . 4.3600000000000003 111.715 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.7 pp -65.41 -34.08 77.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.107 0.479 . . . . 3.21 111.136 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 427' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -77.16 2.88 14.03 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 113.405 0.891 . . . . 5.2699999999999996 113.405 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -57.66 -23.42 51.24 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 120.799 0.333 . . . . 5.7699999999999996 110.76 178.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.667 -0.682 . . . . 5.1100000000000003 110.276 179.699 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 ptt? . . . . . 0 N--CA 1.483 1.209 0 CA-C-O 120.569 0.223 . . . . 1.6499999999999999 110.694 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 71.0 mm-40 -112.48 145.31 40.44 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.901 0.381 . . . . 2.04 111.953 -179.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 20.2 pt -130.12 155.04 41.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.993 -0.549 . . . . 1.48 109.54 178.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -111.14 115.14 28.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.736 0.303 . . . . 2.1699999999999999 110.899 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.6 t -99.97 119.79 48.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.389 -0.368 . . . . 1.6499999999999999 110.615 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -94.57 128.98 41.56 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.299 -0.41 . . . . 3.5099999999999998 110.566 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.22 163.65 12.31 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.206 -0.452 . . . . 2.1699999999999999 110.088 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 27.9 mt -62.85 -20.8 65.44 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.937 0.399 . . . . 3.0499999999999998 111.72 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.3 p -81.84 -3.76 54.83 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.245 -0.434 . . . . 2.7000000000000002 110.846 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.78 -6.87 77.19 Favored Glycine 0 C--N 1.335 0.492 0 N-CA-C 111.369 -0.692 . . . . 2.6400000000000001 111.369 -179.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -68.32 149.67 49.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.35 -0.425 . . . . 2.5600000000000001 110.811 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.3 m -126.19 128.37 47.14 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.366 -0.605 . . . . 2.4100000000000001 109.366 178.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.2 mt -113.35 129.45 69.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.651 -0.25 . . . . 1.8300000000000001 111.461 -178.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.96 110.03 22.31 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.995 -0.743 . . . . 2.1899999999999999 108.995 178.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.7 mt -114.77 142.05 47.05 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.513 0.56 . . . . 1.3600000000000001 112.513 -178.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -84.44 120.24 26.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.423 -0.808 . . . . 2.3999999999999999 109.401 179.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 15.3 m -142.34 178.8 2.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 116.146 -0.479 . . . . 1.25 109.998 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -145.71 163.26 32.3 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 109.019 -0.734 . . . . 1.8500000000000001 109.019 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -55.82 -27.04 60.41 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.418 2.078 . . . . 1.78 112.758 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.07 11.44 18.44 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.301 -0.409 . . . . 2.1200000000000001 111.78 -179.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -86.66 134.17 33.63 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.031 -0.359 . . . . 1.25 110.031 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -92.36 148.69 21.92 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.38 -0.373 . . . . 1.77 110.698 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 44.8 mm -55.36 -41.1 60.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.376 -0.374 . . . . 1.0600000000000001 111.792 -179.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -65.17 -30.04 70.92 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.881 0.372 . . . . 2.2200000000000002 111.266 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -76.2 -37.21 58.09 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.586 -0.524 . . . . 1.3300000000000001 109.586 179.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 66.8 t -64.76 -37.13 79.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.854 -0.612 . . . . 0.67000000000000004 109.922 178.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.503 ' HZ3' ' CG ' ' A' ' 52' ' ' ASP . 92.0 mttt -60.52 -37.1 80.07 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.79 -0.641 . . . . 1.6899999999999999 111.074 179.609 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.29 -36.66 84.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 1.0800000000000001 110.282 179.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 87.0 mttt -65.72 -38.23 88.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.835 -0.62 . . . . 1.48 110.265 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 47.3 mt -70.32 -30.95 45.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.176 -0.465 . . . . 1.3100000000000001 110.312 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -71.09 -34.54 71.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.96 0.409 . . . . 2.0899999999999999 110.205 179.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -72.59 -33.68 66.9 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.145 0.497 . . . . 2.0499999999999998 110.681 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -83.62 -63.11 1.41 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.026 -0.534 . . . . 2.5099999999999998 112.43 -179.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -79.7 -48.61 13.39 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.479 0.548 . . . . 2.1400000000000001 112.479 -178.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 115.8 -12.2 17.94 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.707 -0.759 . . . . 2.0099999999999998 111.727 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 13.0 mt -68.57 124.29 89.67 Favored Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 110.338 -0.245 . . . . 1.8300000000000001 110.338 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -63.12 143.62 90.65 Favored 'Trans proline' 0 C--O 1.233 0.274 0 C-N-CA 122.84 2.36 . . . . 2.04 111.457 179.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -56.7 -23.64 50.57 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.332 2.688 . . . . 1.52 112.297 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.96 -23.41 65.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.97 -0.559 . . . . 2.9500000000000002 110.612 179.55 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -112.06 9.37 20.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.955 -0.566 . . . . 2.73 110.543 -179.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -97.0 100.16 11.68 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.767 -0.651 . . . . 1.4399999999999999 111.244 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 52.4 mtp180 -104.46 103.89 13.66 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.05 -0.722 . . . . 2.9399999999999999 109.05 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.3 mp -104.51 144.1 32.14 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.885 0.698 . . . . 1.02 112.885 -178.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -135.44 151.37 30.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.36 -0.836 . . . . 2.1400000000000001 110.268 179.048 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -121.02 87.74 2.81 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.104 -0.702 . . . . 1.71 109.104 178.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 56.1 65.86 1.34 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.826 -0.625 . . . . 2.1000000000000001 111.946 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 76.13 -9.28 19.86 Favored Glycine 0 CA--C 1.521 0.467 0 CA-C-N 115.801 -0.636 . . . . 1.8400000000000001 114.301 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.3 mtmm -100.88 124.61 46.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 117.25 0.525 . . . . 3.4300000000000002 111.192 -179.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -75.43 134.55 40.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.25 -0.432 . . . . 2.7200000000000002 110.489 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 36.8 mt -93.07 125.56 37.72 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.295 -0.411 . . . . 1.1699999999999999 111.24 -179.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -89.11 132.16 34.93 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.81 -0.441 . . . . 2.6499999999999999 109.81 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.503 ' CG ' ' HZ3' ' A' ' 27' ' ' LYS . 24.0 m-20 -56.19 -30.66 62.57 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.974 0.731 . . . . 1.8300000000000001 112.974 -178.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -87.72 18.23 40.22 Favored Glycine 0 CA--C 1.519 0.286 0 C-N-CA 120.948 -0.644 . . . . 1.8200000000000001 113.356 -179.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 22.4 mmm-85 -120.28 163.61 17.55 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.966 0.383 . . . . 2.9300000000000002 111.099 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.42 169.19 8.68 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.674 -0.694 . . . . 1.71 110.211 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 72.8 mt -63.33 -33.84 76.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.824 0.345 . . . . 1.49 111.527 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.08 -19.1 65.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.188 -0.46 . . . . 2.1000000000000001 111.329 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -65.38 -31.15 72.11 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 116.233 -0.439 . . . . 2.0299999999999998 111.548 -179.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 -111.91 14.23 20.91 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.287 -0.415 . . . . 1.76 110.407 -179.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 48.8 t30 59.67 34.14 22.08 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.455 -0.793 . . . . 3.3700000000000001 111.289 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 72.7 mt -75.66 109.8 9.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.848 -0.615 . . . . 1.6499999999999999 109.725 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -106.14 -166.6 1.21 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.871 -0.604 . . . . 2.79 110.685 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 8.3 pttm -68.95 145.26 53.78 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.409 -0.359 . . . . 3.52 110.993 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 71.74 8.34 6.09 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.495 0.924 . . . . 3.1200000000000001 113.495 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.1 m -72.03 143.31 49.19 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.754 0.312 . . . . 1.8999999999999999 110.262 179.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.43 125.7 46.75 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.192 -0.458 . . . . 2.1600000000000001 111.21 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.0 mp -114.54 146.14 41.1 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.491 -0.929 . . . . 1.4199999999999999 108.491 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 63.8 m80 -109.63 137.63 47.17 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 120.726 0.298 . . . . 3.1499999999999999 111.56 -179.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 52.0 tp -118.35 116.48 26.83 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.934 -0.575 . . . . 1.54 111.128 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 22.9 t -98.71 129.28 49.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.691 -0.686 . . . . 1.79 109.648 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 58.3 mt -76.06 117.74 18.09 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.769 -0.65 . . . . 2.4300000000000002 111.106 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 60.3 ttt180 -93.27 103.15 15.42 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.832 -0.622 . . . . 3.5 110.815 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 34.9 mt -78.8 120.88 24.07 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.099 -0.501 . . . . 2.9900000000000002 110.71 179.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 -83.71 -49.58 8.99 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.255 -0.429 . . . . 3.9199999999999999 110.669 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -133.45 113.99 1.3 Allowed Glycine 0 N--CA 1.445 -0.738 0 C-N-CA 120.723 -0.751 . . . . 3.0800000000000001 111.675 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.521 -1.155 . . . . 3.8199999999999998 111.304 179.688 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.355 0 N-CA-C 111.821 -0.512 . . . . 5.9900000000000002 111.821 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -84.09 54.67 3.02 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.177 0.513 . . . . 5.7999999999999998 110.517 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -83.65 71.79 10.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.006 -0.543 . . . . 4.29 110.564 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.3 -31.79 70.5 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.639 -0.709 . . . . 4.2199999999999998 111.049 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -109.69 121.1 43.16 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 115.865 -0.607 . . . . 2.5499999999999998 110.439 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_exo -70.04 130.87 19.71 Favored 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.792 2.328 . . . . 3.77 111.359 179.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -50.67 -49.22 57.72 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.886 0.699 . . . . 5.3600000000000003 112.886 -179.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -60.22 -42.15 94.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.437 -0.347 . . . . 6.8899999999999997 111.086 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 11.2 m -63.74 -43.4 96.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.037 -0.528 . . . . 4.2000000000000002 110.969 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 395' ' ' ILE . . . . . . . . . . . . . 84.8 mt -59.14 -49.27 83.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.493 -0.321 . . . . 3.7999999999999998 110.685 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -61.51 -42.95 99.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.007 -0.542 . . . . 6.5800000000000001 111.281 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -64.6 -44.67 89.87 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.777 0.322 . . . . 7.46 111.217 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 98.1 mt -66.59 -37.97 86.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 4.3099999999999996 111.717 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 39.0 mtp -67.51 -32.79 73.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.459 -0.337 . . . . 5.7999999999999998 111.397 179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -65.66 -28.55 69.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.267 -0.424 . . . . 7.71 111.215 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 14.3 mt -64.97 -18.46 65.29 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.131 0.491 . . . . 5.6900000000000004 110.681 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 107.91 23.28 6.85 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.76 -0.655 . . . . 5.8700000000000001 111.524 -179.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -114.38 139.44 23.88 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-O 120.768 0.318 . . . . 4.8399999999999999 110.806 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -77.16 164.39 29.39 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.671 2.248 . . . . 4.7199999999999998 112.056 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 56.3 mtt180 -60.11 -28.06 67.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.835 -0.62 . . . . 4.4400000000000004 110.798 179.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -58.07 -44.65 87.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.712 -0.676 . . . . 4.6900000000000004 110.675 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -67.66 -36.3 80.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.635 -0.711 . . . . 3.2599999999999998 110.117 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 91.0 t -60.96 -53.27 51.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.659 -0.7 . . . . 2.1600000000000001 110.521 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 88.1 t -54.8 -49.51 68.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.136 -0.484 . . . . 2.8900000000000001 112.046 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -66.23 -49.51 66.98 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.747 0.647 . . . . 5.5 112.747 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -64.16 -48.5 75.76 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.374 0.509 . . . . 2.96 112.374 -178.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -62.72 -39.82 95.24 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.463 0.542 . . . . 3.4500000000000002 112.463 -178.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 13.4 mmmt -64.26 -42.29 96.53 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.147 0.425 . . . . 5.8499999999999996 112.147 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -77.87 -8.91 58.71 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.478 0.547 . . . . 5.5300000000000002 112.478 -179.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 25.3 p -113.3 8.23 17.99 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.754 0.311 . . . . 5.4199999999999999 111.63 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 61.33 39.78 15.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.071 -0.513 . . . . 6.6399999999999997 112.362 179.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 79.7 -15.68 13.56 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.715 -0.755 . . . . 4.3300000000000001 114.194 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -67.9 106.06 2.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 117.973 0.886 . . . . 6.4000000000000004 110.99 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -62.59 -25.8 68.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.969 -1.014 . . . . 4.3300000000000001 112.903 -178.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -60.18 -56.4 22.09 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.2 0.524 . . . . 6.9900000000000002 110.69 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 23.4 m-85 -73.86 -29.27 62.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.081 -0.509 . . . . 7.4800000000000004 110.415 179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -61.4 -46.56 89.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.297 -0.41 . . . . 3.8399999999999999 110.557 179.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -64.78 -38.52 91.28 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.982 -0.554 . . . . 3.7999999999999998 110.381 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 1.3 t -70.1 -26.15 63.84 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.13 -0.486 . . . . 5.0499999999999998 110.503 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -79.56 -49.77 11.72 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 116.095 -0.502 . . . . 4.3600000000000003 111.401 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.2 pp -61.46 -33.19 73.34 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.132 0.419 . . . . 3.21 112.132 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 427' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -61.84 -12.51 17.84 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.871 0.693 . . . . 5.2699999999999996 112.871 -179.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -67.7 -7.53 27.81 Favored 'General case' 0 C--O 1.235 0.314 0 O-C-N 122.216 -0.302 . . . . 5.7699999999999996 111.51 179.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.654 -0.689 . . . . 5.1100000000000003 110.511 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.0 ptt? . . . . . 0 N--CA 1.476 0.859 0 CA-C-O 120.867 0.365 . . . . 1.6499999999999999 110.492 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 65.3 mm-40 -87.01 142.4 27.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.935 0.398 . . . . 2.04 111.296 -179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 27.6 pt -127.58 162.51 32.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.862 -0.608 . . . . 1.48 109.874 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 68.5 m-85 -112.35 117.03 31.34 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.57 -0.287 . . . . 2.1699999999999999 110.442 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 36.1 t -106.04 124.65 61.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.439 -0.346 . . . . 1.6499999999999999 110.375 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -100.37 155.72 17.65 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.213 -0.449 . . . . 3.5099999999999998 110.762 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.0 p -128.25 169.16 14.51 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.722 -0.844 . . . . 2.1699999999999999 108.722 178.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 96.2 mt -71.29 -4.38 25.63 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.997 0.369 . . . . 3.0499999999999998 111.997 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.92 11.75 38.07 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.002 0.43 . . . . 2.7000000000000002 110.911 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.85 18.47 74.3 Favored Glycine 0 N--CA 1.451 -0.362 0 CA-C-N 115.935 -0.575 . . . . 2.6400000000000001 112.786 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -95.15 127.0 40.86 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.643 0.259 . . . . 2.5600000000000001 110.402 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.7 m -107.79 126.34 52.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.345 -0.389 . . . . 2.4100000000000001 110.11 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.7 mt -116.48 144.76 23.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 116.289 -0.414 . . . . 1.8300000000000001 110.432 -179.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.33 143.08 30.94 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.94 -0.393 . . . . 2.1899999999999999 109.94 179.251 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.5 mt -138.96 143.12 38.43 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.702 0.287 . . . . 1.3600000000000001 111.594 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -97.32 108.79 21.59 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.987 -0.746 . . . . 2.3999999999999999 108.987 178.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 4.6 m -135.34 168.58 22.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 116.471 -0.331 . . . . 1.25 110.749 -179.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 61.1 mm-40 -127.69 159.46 65.99 Favored Pre-proline 0 C--N 1.319 -0.725 0 N-CA-C 109.316 -0.624 . . . . 1.8500000000000001 109.316 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -52.55 -35.98 69.1 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.79 2.326 . . . . 1.78 112.806 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.56 3.36 22.04 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.74 0.644 . . . . 2.1200000000000001 112.74 -179.06 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -79.88 138.22 37.11 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.907 -0.317 . . . . 1.25 111.146 -179.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -86.74 147.91 25.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.049 -0.523 . . . . 1.77 110.488 -179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 48.5 mm -56.78 -36.48 49.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-O 120.872 0.367 . . . . 1.0600000000000001 110.655 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -58.26 -43.44 87.88 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.9 -0.591 . . . . 2.2200000000000002 109.915 178.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -70.07 -35.83 74.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.74 -0.663 . . . . 1.3300000000000001 110.323 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 98.2 t -62.54 -44.41 99.31 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 N-CA-C 109.646 -0.501 . . . . 0.67000000000000004 109.646 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -63.21 -34.67 78.15 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.176 -0.466 . . . . 1.6899999999999999 110.16 179.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.86 -34.79 78.95 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.054 -0.521 . . . . 1.0800000000000001 109.627 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -68.76 -34.99 76.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.779 -0.646 . . . . 1.48 109.857 178.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 57.5 mt -72.56 -40.85 63.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 108.86 -0.793 . . . . 1.3100000000000001 108.86 178.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -60.57 -37.05 80.04 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.599 -0.728 . . . . 2.0899999999999999 110.626 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -65.13 -30.54 71.47 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.07 -0.514 . . . . 2.0499999999999998 111.751 -179.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -93.12 -49.25 6.09 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 113.074 0.768 . . . . 2.5099999999999998 113.074 -178.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 51.5 mm-40 -88.45 -19.34 26.64 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 113.4 0.889 . . . . 2.1400000000000001 113.4 -177.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.28 24.37 77.04 Favored Glycine 0 N--CA 1.453 -0.202 0 C-N-CA 120.717 -0.754 . . . . 2.0099999999999998 112.57 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 77.1 mt -99.03 129.82 28.77 Favored Pre-proline 0 C--N 1.327 -0.384 0 O-C-N 122.869 -0.195 . . . . 1.8300000000000001 110.642 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -52.1 136.39 53.41 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 123.028 2.485 . . . . 2.04 112.493 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -64.84 -15.22 49.2 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.971 2.448 . . . . 1.52 112.902 -179.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -78.76 -26.91 44.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.996 0.427 . . . . 2.9500000000000002 110.607 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -94.77 -11.15 29.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.215 0.531 . . . . 2.73 110.084 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -78.98 109.9 13.71 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.464 -0.789 . . . . 1.4399999999999999 111.72 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 7.9 mmt180 -111.35 102.16 10.57 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.436 -0.579 . . . . 2.9399999999999999 109.436 178.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 18.0 mt -88.64 135.21 33.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.157 -0.474 . . . . 1.02 111.759 -179.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -129.89 150.16 34.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.846 -0.615 . . . . 2.1400000000000001 110.673 179.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -133.48 96.04 3.63 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.654 -0.703 . . . . 1.71 109.144 178.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.68 39.81 20.65 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.795 -0.638 . . . . 2.1000000000000001 111.867 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.23 -16.56 61.05 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.734 -0.746 . . . . 1.8400000000000001 113.153 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 42.4 mtmt -93.11 114.57 27.13 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 122.821 -0.223 . . . . 3.4300000000000002 111.157 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -68.35 136.36 53.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.269 -0.423 . . . . 2.7200000000000002 110.365 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 18.6 mt -92.59 122.74 35.31 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.261 -0.427 . . . . 1.1699999999999999 111.883 -178.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -80.13 150.02 30.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.1 -0.5 . . . . 2.6499999999999999 110.475 179.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -65.54 -33.43 75.9 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.791 -0.64 . . . . 1.8300000000000001 111.992 -178.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -85.2 17.09 34.89 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.995 -0.622 . . . . 1.8200000000000001 114.353 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -117.11 165.24 13.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 117.285 0.542 . . . . 2.9300000000000002 110.868 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 19.5 p -109.49 177.78 4.64 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.044 -0.525 . . . . 1.71 109.589 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 75.9 mt -67.22 -36.68 82.2 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.836 0.35 . . . . 1.49 111.111 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.2 m -67.22 -21.76 65.74 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.326 -0.397 . . . . 2.1000000000000001 111.561 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -67.67 -28.34 67.61 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.544 -0.298 . . . . 2.0299999999999998 111.247 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -112.58 14.3 20.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.824 0.345 . . . . 1.76 111.058 -179.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 59.32 38.13 23.22 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.723 -0.672 . . . . 3.3700000000000001 111.455 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 73.7 mt -84.39 107.76 15.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.015 -0.539 . . . . 1.6499999999999999 109.848 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -101.46 -167.06 1.37 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.87 -0.605 . . . . 2.79 110.58 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 56.3 pttt -72.4 144.5 48.16 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.693 0.282 . . . . 3.52 111.261 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 68.84 18.87 8.5 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.61 -0.723 . . . . 3.1200000000000001 112.939 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 51.5 m -76.58 154.74 34.18 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.74 -0.467 . . . . 1.8999999999999999 109.74 178.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.4 m -105.76 119.55 39.44 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.934 0.397 . . . . 2.1600000000000001 111.099 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.4 mp -111.34 148.98 31.81 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.671 -0.695 . . . . 1.4199999999999999 109.193 179.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -116.1 137.56 52.02 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 120.721 0.296 . . . . 3.1499999999999999 111.188 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 33.4 tp -116.16 115.01 25.25 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.158 -0.474 . . . . 1.54 111.329 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 39.7 t -105.24 132.58 51.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.995 -0.548 . . . . 1.79 110.091 179.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 78.3 mt -91.26 109.55 20.82 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.448 -0.575 . . . . 2.4300000000000002 109.448 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 23.3 ttt180 -92.06 117.69 30.08 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.142 0.496 . . . . 3.5 111.159 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.8 mt -89.01 155.89 19.2 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.689 -0.687 . . . . 2.9900000000000002 110.3 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.1 mmt180 -92.48 -7.12 48.32 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.27 0.557 . . . . 3.9199999999999999 109.979 179.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -166.64 166.08 38.78 Favored Glycine 0 N--CA 1.442 -0.904 0 N-CA-C 110.626 -0.99 . . . . 3.0800000000000001 110.626 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.154 -1.359 . . . . 3.8199999999999998 111.24 -179.95 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.773 0 N-CA-C 111.963 -0.455 . . . . 5.9900000000000002 111.963 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 3.6 m -85.1 64.82 8.9 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.209 0.528 . . . . 5.7999999999999998 110.744 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -80.69 74.54 7.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.931 -0.577 . . . . 4.29 111.106 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.18 -7.37 57.0 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.13 0.491 . . . . 4.2199999999999998 110.353 179.251 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -129.09 97.48 26.11 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 115.993 -0.548 . . . . 2.5499999999999998 110.481 -179.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -64.83 147.63 89.59 Favored 'Trans proline' 0 C--O 1.235 0.361 0 C-N-CA 122.645 2.23 . . . . 3.77 111.349 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -49.86 -59.23 4.04 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 113.588 0.959 . . . . 5.3600000000000003 113.588 -178.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -48.91 -52.41 24.7 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.554 0.575 . . . . 6.8899999999999997 112.554 -179.031 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -43.11 77.74 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.348 -0.387 . . . . 4.2000000000000002 111.759 -179.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 395' ' ' ILE . . . . . . . . . . . . . 75.0 mt -66.16 -51.82 55.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.412 -0.358 . . . . 3.7999999999999998 110.399 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -57.78 -40.38 79.7 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.961 -0.563 . . . . 6.5800000000000001 112.099 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -63.72 -43.52 96.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.932 0.396 . . . . 7.46 110.703 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -73.98 -33.9 64.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.95 -0.568 . . . . 4.3099999999999996 111.801 -179.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 30.3 mmt -67.12 -40.94 86.9 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.821 0.343 . . . . 5.7999999999999998 111.269 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -63.76 -24.52 67.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 7.71 112.119 -178.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 31.9 mt -63.29 -23.28 67.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.026 0.441 . . . . 5.6900000000000004 110.879 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 109.78 42.23 1.24 Allowed Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 121.039 -0.6 . . . . 5.8700000000000001 111.614 -179.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -129.49 153.46 80.65 Favored Pre-proline 0 C--N 1.325 -0.464 0 N-CA-C 110.527 -0.175 . . . . 4.8399999999999999 110.527 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -83.82 160.07 14.05 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 122.724 2.283 . . . . 4.7199999999999998 112.612 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 23.7 ttt180 -61.04 -30.83 70.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.579 -0.737 . . . . 4.4400000000000004 110.379 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -56.68 -43.91 80.91 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.563 -0.744 . . . . 4.6900000000000004 110.714 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -71.82 -42.09 67.42 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.707 -0.679 . . . . 3.2599999999999998 112.124 -179.081 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 4.2 p -61.61 -37.3 77.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 111.989 0.366 . . . . 2.1600000000000001 111.989 -179.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 71.9 t -68.94 -48.21 71.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.648 0.261 . . . . 2.8900000000000001 110.79 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 82.5 mttt -61.3 -44.15 97.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.975 0.417 . . . . 5.5 111.167 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -66.0 -49.59 67.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.915 -0.584 . . . . 2.96 111.725 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 45.3 mt -62.49 -32.38 73.28 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.774 0.657 . . . . 3.4500000000000002 112.774 -179.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 61.4 mmtt -69.18 -45.25 70.44 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.923 -0.311 . . . . 5.8499999999999996 111.721 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 29.0 pt20 -75.28 -26.94 59.15 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.925 0.713 . . . . 5.5300000000000002 112.925 -178.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 41.2 p -94.61 -3.28 49.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.084 0.469 . . . . 5.4199999999999999 111.146 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 61.82 60.85 1.5 Allowed 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.563 0.949 . . . . 6.6399999999999997 113.563 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 72.03 -24.16 0.7 Allowed Glycine 0 CA--C 1.522 0.5 0 N-CA-C 115.945 1.138 . . . . 4.3300000000000001 115.945 177.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.37 103.09 2.32 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 122.0 0.905 . . . . 6.4000000000000004 110.944 -179.543 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -66.24 -20.66 66.18 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 115.023 -0.989 . . . . 4.3300000000000001 112.69 -178.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -61.69 -50.33 72.9 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.481 0.658 . . . . 6.9900000000000002 109.305 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -80.46 -27.11 37.96 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.546 -0.752 . . . . 7.4800000000000004 109.823 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -61.35 -48.09 82.88 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 110.02 -0.363 . . . . 3.8399999999999999 110.02 178.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -65.68 -40.51 92.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.854 -0.612 . . . . 3.7999999999999998 109.685 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 21.6 m -61.41 -39.39 90.56 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.749 -0.659 . . . . 5.0499999999999998 111.069 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.69 -46.84 23.99 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.291 -0.413 . . . . 4.3600000000000003 110.979 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.3 -37.06 76.77 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.988 0.366 . . . . 3.21 111.988 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 427' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -77.25 3.15 13.58 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 113.621 0.971 . . . . 5.2699999999999996 113.621 -178.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -56.94 -20.98 26.54 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.251 0.463 . . . . 5.7699999999999996 112.251 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 14.2 m . . . . . 0 C--O 1.251 1.134 0 CA-C-O 118.61 -0.709 . . . . 5.1100000000000003 111.328 -179.777 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.8 ptt? . . . . . 0 N--CA 1.481 1.094 0 CA-C-O 120.577 0.227 . . . . 1.6499999999999999 110.423 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -109.28 138.17 46.04 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 111.967 0.358 . . . . 2.04 111.967 -179.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 16.0 pt -130.32 159.38 42.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.779 -0.646 . . . . 1.48 109.534 178.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -121.03 123.65 42.91 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.75 0.309 . . . . 2.1699999999999999 110.574 -179.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.4 t -105.42 127.22 60.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.451 -0.34 . . . . 1.6499999999999999 111.008 -179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.1 mmtp -92.65 128.3 38.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.282 -0.417 . . . . 3.5099999999999998 110.829 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.06 164.76 11.56 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.224 -0.444 . . . . 2.1699999999999999 110.751 179.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 10.5 mt -64.12 -15.56 59.95 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.413 0.523 . . . . 3.0499999999999998 112.413 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -90.79 5.23 49.19 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.936 0.398 . . . . 2.7000000000000002 110.632 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.13 3.97 90.58 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.858 -0.687 . . . . 2.6400000000000001 111.416 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -75.11 148.41 39.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.413 -0.393 . . . . 2.5600000000000001 111.037 -179.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.9 m -119.3 108.19 14.31 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.802 -0.814 . . . . 2.4100000000000001 108.802 178.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 17.9 mt -92.49 126.51 44.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.33 -0.396 . . . . 1.8300000000000001 111.466 -178.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.0 122.6 34.66 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.196 -0.668 . . . . 2.1899999999999999 109.196 178.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 76.2 mt -122.25 137.94 54.66 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 112.429 0.529 . . . . 1.3600000000000001 112.429 -178.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -90.78 108.5 19.87 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.259 -1.015 . . . . 2.3999999999999999 108.259 178.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.9 m -139.49 173.82 10.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.048 0.451 . . . . 1.25 111.056 -178.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 36.5 mm-40 -138.93 157.31 71.8 Favored Pre-proline 0 C--N 1.32 -0.708 0 N-CA-C 107.923 -1.14 . . . . 1.8500000000000001 107.923 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -50.1 -33.04 33.73 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.749 2.299 . . . . 1.78 112.883 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.5 m -74.36 -10.17 59.32 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.799 0.666 . . . . 2.1200000000000001 112.799 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -77.33 135.46 38.38 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.85 -0.426 . . . . 1.25 109.85 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -86.16 150.12 24.63 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.538 -0.301 . . . . 1.77 110.945 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 43.5 mm -55.66 -36.06 41.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-O 121.033 0.444 . . . . 1.0600000000000001 110.427 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -59.42 -41.37 89.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.581 -0.736 . . . . 2.2200000000000002 110.695 179.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -71.6 -34.84 70.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.032 -0.531 . . . . 1.3300000000000001 110.679 -179.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.8 t -60.62 -42.61 92.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.069 -0.514 . . . . 0.67000000000000004 109.725 179.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.2 mtmt -62.74 -36.39 82.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.926 -0.579 . . . . 1.6899999999999999 110.63 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.45 -35.54 80.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.985 -0.552 . . . . 1.0800000000000001 110.55 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -67.74 -37.34 82.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.018 -0.537 . . . . 1.48 109.909 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 54.2 mt -70.99 -33.05 50.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.027 -0.533 . . . . 1.3100000000000001 110.196 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -64.84 -34.6 78.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.943 -0.571 . . . . 2.0899999999999999 110.803 179.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -81.18 -36.2 30.45 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.291 -0.413 . . . . 2.0499999999999998 111.157 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 75.6 mttt -76.48 -55.38 5.58 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.399 0.518 . . . . 2.5099999999999998 112.399 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 55.7 mm-40 -85.74 -42.29 14.35 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.118 0.414 . . . . 2.1400000000000001 112.118 -178.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 105.55 8.05 35.81 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.614 -0.803 . . . . 2.0099999999999998 111.361 -179.097 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 24.9 mt -89.58 121.09 69.5 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.73 -0.47 . . . . 1.8300000000000001 109.73 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_exo -54.39 135.32 65.26 Favored 'Trans proline' 0 C--N 1.342 0.231 0 C-N-CA 122.907 2.405 . . . . 2.04 111.409 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.23 -22.39 64.65 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 123.302 2.668 . . . . 1.52 112.373 -179.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -77.4 -23.21 50.7 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.928 -0.578 . . . . 2.9500000000000002 110.882 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -102.56 7.74 40.0 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.119 0.485 . . . . 2.73 110.634 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -91.34 176.16 6.66 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.472 -0.785 . . . . 1.4399999999999999 110.475 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.37 94.51 1.08 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.85 -0.796 . . . . 2.9399999999999999 108.85 179.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 16.8 mt -100.18 123.19 44.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.094 0.473 . . . . 1.02 112.263 -178.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 20.0 pt -132.78 163.07 38.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.706 -0.679 . . . . 2.1400000000000001 109.687 178.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -130.09 112.74 13.72 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.465 -0.334 . . . . 1.71 110.281 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.58 35.11 22.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.791 -0.641 . . . . 2.1000000000000001 111.98 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.3 -17.67 56.57 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.771 -0.728 . . . . 1.8400000000000001 113.249 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -95.39 126.27 40.58 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.112 -0.329 . . . . 3.4300000000000002 110.112 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.14 151.08 48.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.054 0.454 . . . . 2.7200000000000002 111.705 -178.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 18.9 mt -108.64 132.52 53.82 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.574 -0.739 . . . . 1.1699999999999999 110.206 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -86.85 146.78 26.08 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.401 -0.363 . . . . 2.6499999999999999 110.667 179.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -61.76 -34.76 76.43 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 112.713 0.634 . . . . 1.8300000000000001 112.713 -178.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -85.12 14.23 50.56 Favored Glycine 0 N--CA 1.453 -0.217 0 C-N-CA 120.962 -0.637 . . . . 1.8200000000000001 113.043 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 30.1 mmt180 -112.45 152.0 29.23 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.027 0.441 . . . . 2.9300000000000002 110.456 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 68.4 p -99.19 175.26 5.95 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 108.891 -0.781 . . . . 1.71 108.891 179.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 88.0 mt -68.93 -31.54 70.5 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.357 -0.608 . . . . 1.49 109.357 178.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.89 -28.53 68.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.555 -0.748 . . . . 2.1000000000000001 110.632 178.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -60.34 -32.41 71.23 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.112 -0.495 . . . . 2.0299999999999998 111.118 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -108.82 12.0 25.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.233 -0.44 . . . . 1.76 111.58 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 61.4 30.21 18.85 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.911 -0.586 . . . . 3.3700000000000001 111.707 -179.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 86.4 mt -74.42 116.59 17.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 109.375 -0.602 . . . . 1.6499999999999999 109.375 179.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -109.5 -163.24 0.85 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.953 -0.567 . . . . 2.79 110.306 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.9 pttt -73.86 149.43 41.56 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.677 -0.238 . . . . 3.52 110.815 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 69.41 19.15 7.72 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.711 0.634 . . . . 3.1200000000000001 112.711 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.3 m -82.3 146.76 29.26 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.784 0.326 . . . . 1.8999999999999999 110.328 179.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 10.3 m -105.33 120.9 42.72 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.045 0.45 . . . . 2.1600000000000001 111.539 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.5 mp -102.62 147.27 27.0 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.7 -0.682 . . . . 1.4199999999999999 109.461 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 23.9 m80 -105.57 129.78 53.76 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.579 -0.282 . . . . 3.1499999999999999 110.936 -179.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 29.1 tp -123.4 121.86 36.82 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.254 -0.43 . . . . 1.54 110.781 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -116.88 153.41 18.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.311 -0.404 . . . . 1.79 110.917 179.612 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 95.9 mt -85.89 131.23 34.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.077 0.465 . . . . 2.4300000000000002 111.203 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 12.1 ttt180 -106.16 80.01 1.46 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.858 -0.61 . . . . 3.5 109.501 178.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 77.6 mt -63.18 150.06 43.86 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.726 -0.67 . . . . 2.9900000000000002 111.417 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 14.5 mmt85 -103.36 -63.25 1.2 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.072 -0.513 . . . . 3.9199999999999999 110.087 179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -114.77 146.35 18.77 Favored Glycine 0 N--CA 1.445 -0.746 0 N-CA-C 111.107 -0.797 . . . . 3.0800000000000001 111.107 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.152 0 CA-C-O 118.754 -1.026 . . . . 3.8199999999999998 111.869 -179.701 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.654 0 N-CA-C 111.271 -0.732 . . . . 5.9900000000000002 111.271 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 1.9 m -71.76 94.66 1.41 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.063 0.458 . . . . 5.7999999999999998 110.147 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -118.89 32.81 5.94 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.884 -0.598 . . . . 4.29 110.635 -179.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.12 -25.27 68.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.631 -0.713 . . . . 4.2199999999999998 110.607 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -109.92 113.42 57.25 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 115.754 -0.657 . . . . 2.5499999999999998 110.228 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_exo -72.67 121.09 7.1 Favored 'Trans proline' 0 C--O 1.235 0.347 0 C-N-CA 123.054 2.503 . . . . 3.77 111.968 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -51.19 -50.34 59.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.873 -0.603 . . . . 5.3600000000000003 112.514 -179.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -55.16 -50.12 70.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.025 -0.534 . . . . 6.8899999999999997 111.918 -179.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 2.1 m -61.18 -45.18 95.67 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.032 -0.531 . . . . 4.2000000000000002 111.29 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 395' ' ' ILE . . . . . . . . . . . . . 75.0 mt -60.64 -48.71 87.48 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.109 0 CA-C-O 120.662 0.268 . . . . 3.7999999999999998 110.848 179.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 73.3 mttt -58.28 -41.27 84.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 6.5800000000000001 111.925 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -68.33 -36.8 79.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.841 0.353 . . . . 7.46 110.723 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 83.4 mt -68.43 -24.28 64.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.285 -0.416 . . . . 4.3099999999999996 111.051 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 23.1 mmt -68.36 -25.11 64.92 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.04 0.448 . . . . 5.7999999999999998 110.63 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -73.96 -11.43 60.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.886 -0.597 . . . . 7.71 111.416 -179.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 74.9 mt -86.03 16.96 3.79 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.035 0.383 . . . . 5.6900000000000004 112.035 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 62.53 47.3 90.36 Favored Glycine 0 CA--C 1.518 0.227 0 C-N-CA 121.07 -0.586 . . . . 5.8700000000000001 112.589 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -134.51 150.3 73.36 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-O 120.361 0.124 . . . . 4.8399999999999999 110.802 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -69.49 153.35 70.29 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.955 2.437 . . . . 4.7199999999999998 112.204 179.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 25.9 ttt180 -68.76 -41.0 79.47 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.123 0.416 . . . . 4.4400000000000004 112.123 -178.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -59.6 -37.31 78.24 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.405 -0.361 . . . . 4.6900000000000004 111.527 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -61.72 -39.38 91.3 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.244 -0.434 . . . . 3.2599999999999998 110.518 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 55.2 t -66.09 -40.75 88.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.85 -0.614 . . . . 2.1600000000000001 110.11 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 88.6 t -60.24 -46.01 95.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.033 -0.531 . . . . 2.8900000000000001 110.189 179.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 19.2 mttp -67.69 -39.3 84.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.984 -0.553 . . . . 5.5 111.155 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -65.81 -49.2 69.12 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.181 -0.463 . . . . 2.96 111.309 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 46.5 mt -63.63 -30.7 71.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.452 -0.34 . . . . 3.4500000000000002 111.375 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -64.66 -49.06 72.48 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.32 -0.4 . . . . 5.8499999999999996 111.041 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -80.05 -9.73 59.72 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.207 0.817 . . . . 5.5300000000000002 113.207 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 31.4 p -107.75 -4.99 17.59 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.759 0.314 . . . . 5.4199999999999999 110.96 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 55.1 m-80 64.91 55.4 1.19 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.857 -0.611 . . . . 6.6399999999999997 112.501 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 72.71 -6.94 10.05 Favored Glycine 0 CA--C 1.519 0.287 0 CA-C-N 115.864 -0.607 . . . . 4.3300000000000001 114.253 178.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -67.8 93.99 0.43 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.018 0.437 . . . . 6.4000000000000004 110.15 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -59.08 -35.88 74.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.527 -0.76 . . . . 4.3300000000000001 112.287 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -71.94 -43.79 64.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.883 0.373 . . . . 6.9900000000000002 110.674 -179.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -67.78 -39.68 84.04 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.189 -0.46 . . . . 7.4800000000000004 109.861 179.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -61.73 -38.99 89.99 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.779 -0.646 . . . . 3.8399999999999999 110.436 179.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -57.3 -48.8 77.99 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.009 -0.541 . . . . 3.7999999999999998 110.613 179.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -63.12 -30.88 71.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.053 -0.521 . . . . 5.0499999999999998 111.612 179.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -81.82 -50.25 9.44 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 113.747 1.017 . . . . 4.3600000000000003 113.747 -178.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.3 pp -62.63 -34.25 76.66 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.126 0.788 . . . . 3.21 113.126 -178.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 427' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -67.04 -13.03 61.52 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.341 0.867 . . . . 5.2699999999999996 113.341 -179.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.39 -18.63 57.15 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 120.809 -0.356 . . . . 5.7699999999999996 111.811 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 6.6 m . . . . . 0 C--O 1.247 0.954 0 CA-C-O 118.676 -0.678 . . . . 5.1100000000000003 110.9 -179.372 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 ptt? . . . . . 0 N--CA 1.481 1.099 0 N-CA-C 110.204 -0.295 . . . . 1.6499999999999999 110.204 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 89.2 mm-40 -102.27 135.33 44.06 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.914 0.388 . . . . 2.04 111.582 -179.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.3 pt -126.63 151.93 33.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.027 -0.533 . . . . 1.48 109.916 178.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -108.93 124.75 51.16 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.673 -0.239 . . . . 2.1699999999999999 111.167 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.1 t -111.8 118.83 58.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.42 -0.585 . . . . 1.6499999999999999 109.42 179.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -102.09 132.68 47.81 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.0 0.429 . . . . 3.5099999999999998 111.727 -179.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 26.5 p -99.06 175.85 5.77 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.959 -0.564 . . . . 2.1699999999999999 110.224 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 92.8 mt -79.28 10.61 3.52 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.914 0.388 . . . . 3.0499999999999998 111.7 -179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -110.04 3.52 20.43 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.318 -0.401 . . . . 2.7000000000000002 110.71 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 80.18 24.88 58.62 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.796 -0.716 . . . . 2.6400000000000001 111.783 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -106.35 134.88 48.79 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.584 0.23 . . . . 2.5600000000000001 110.499 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.1 m -115.64 109.48 17.81 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.961 0.41 . . . . 2.4100000000000001 110.755 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.5 mt -95.26 138.48 20.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.893 -0.594 . . . . 1.8300000000000001 110.428 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.5 m -101.94 115.09 29.78 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.761 -0.459 . . . . 2.1899999999999999 109.761 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.1 mt -105.07 143.32 33.41 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.059 0.456 . . . . 1.3600000000000001 112.124 -179.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -98.97 101.51 12.93 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.46 -0.791 . . . . 2.3999999999999999 109.609 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 16.3 m -138.2 -179.0 2.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.991 -0.549 . . . . 1.25 110.821 -178.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -132.78 157.72 77.62 Favored Pre-proline 0 C--N 1.323 -0.584 0 N-CA-C 109.035 -0.728 . . . . 1.8500000000000001 109.035 179.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -53.34 -29.67 48.95 Favored 'Trans proline' 0 CA--C 1.533 0.467 0 C-N-CA 122.882 2.388 . . . . 1.78 113.058 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.98 -5.48 48.8 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.14 0.422 . . . . 2.1200000000000001 112.14 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -74.07 144.04 45.18 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.029 0.442 . . . . 1.25 110.757 -179.693 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -93.48 145.13 24.73 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.798 -0.637 . . . . 1.77 110.075 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 46.1 mm -53.34 -42.77 49.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 O-C-N 123.166 0.291 . . . . 1.0600000000000001 111.469 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -56.59 -44.34 80.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.366 -0.379 . . . . 2.2200000000000002 110.7 179.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -67.27 -37.31 83.26 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.961 -0.563 . . . . 1.3300000000000001 110.667 -179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 87.2 t -61.37 -43.49 96.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.086 -0.506 . . . . 0.67000000000000004 110.462 179.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.8 mtmt -63.33 -34.17 77.12 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.209 -0.451 . . . . 1.6899999999999999 110.976 179.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -64.96 -32.81 74.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.086 -0.506 . . . . 1.0800000000000001 110.132 179.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.4 mttt -71.04 -37.43 72.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.009 -0.542 . . . . 1.48 109.827 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.3 mt -66.77 -38.23 81.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 109.084 -0.71 . . . . 1.3100000000000001 109.084 178.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -65.63 -37.34 86.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.753 -0.658 . . . . 2.0899999999999999 110.596 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -67.72 -37.17 81.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.219 -0.446 . . . . 2.0499999999999998 112.019 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -87.3 -54.48 4.28 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 113.046 0.758 . . . . 2.5099999999999998 113.046 -178.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -77.36 -35.85 54.16 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.702 0.63 . . . . 2.1400000000000001 112.702 -178.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 91.57 13.77 57.83 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.454 -0.879 . . . . 2.0099999999999998 111.835 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.0 mt -95.17 123.77 56.01 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 110.075 -0.343 . . . . 1.8300000000000001 110.075 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -52.98 137.81 61.84 Favored 'Trans proline' 0 CA--C 1.532 0.378 0 C-N-CA 123.083 2.522 . . . . 2.04 112.33 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -62.57 -18.7 64.99 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.943 2.429 . . . . 1.52 111.974 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -71.13 -25.4 62.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.953 -0.567 . . . . 2.9500000000000002 110.238 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -102.15 6.65 40.91 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.043 -0.526 . . . . 2.73 110.368 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -98.6 114.95 27.61 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.924 -0.58 . . . . 1.4399999999999999 111.661 -179.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 66.6 mtp180 -116.59 101.59 8.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.241 -0.436 . . . . 2.9399999999999999 109.979 178.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 21.7 mt -77.33 128.26 33.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.894 0.378 . . . . 1.02 111.26 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 53.5 mt -124.88 137.63 56.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.669 -0.696 . . . . 2.1400000000000001 110.772 -179.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -132.7 113.22 12.73 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.038 -0.727 . . . . 1.71 109.038 178.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 63.16 30.36 16.01 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.22 -0.446 . . . . 2.1000000000000001 112.01 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 86.04 4.06 84.7 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.871 -0.681 . . . . 1.8400000000000001 113.089 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 41.6 mtmt -116.49 136.75 52.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.766 0.283 . . . . 3.4300000000000002 110.906 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -73.6 145.87 45.1 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.199 -0.455 . . . . 2.7200000000000002 110.529 179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 26.1 mt -105.33 140.4 38.52 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.297 -0.41 . . . . 1.1699999999999999 110.594 179.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -80.47 138.41 36.57 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.715 -0.476 . . . . 2.6499999999999999 109.715 179.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -64.77 -28.37 69.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.948 0.404 . . . . 1.8300000000000001 111.06 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -86.37 22.85 11.23 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 115.82 -0.627 . . . . 1.8200000000000001 112.808 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 37.0 mmt180 -120.86 160.83 22.62 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.911 -0.403 . . . . 2.9300000000000002 109.911 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 35.2 p -103.8 174.44 5.87 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.922 -0.399 . . . . 1.71 109.922 179.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 85.8 mt -66.86 -35.99 81.31 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.168 0.508 . . . . 1.49 110.346 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.4 m -65.88 -21.85 66.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.828 -0.624 . . . . 2.1000000000000001 110.339 178.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -68.14 -21.51 64.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.784 -0.644 . . . . 2.0299999999999998 112.158 -179.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -120.98 16.48 11.7 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.705 0.288 . . . . 1.76 111.271 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 60.99 28.71 18.49 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.729 -0.669 . . . . 3.3700000000000001 111.617 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 67.2 mt -78.76 114.53 19.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.212 -0.449 . . . . 1.6499999999999999 110.658 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -107.92 -165.99 1.1 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.753 -0.658 . . . . 2.79 110.117 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.77 152.57 40.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.695 -0.23 . . . . 3.52 110.985 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 73.16 1.7 4.1 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 112.688 0.625 . . . . 3.1200000000000001 112.688 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.0 m -74.06 146.24 43.83 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.755 0.312 . . . . 1.8999999999999999 110.963 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.0 m -108.93 129.13 55.42 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.814 0.34 . . . . 2.1600000000000001 111.192 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.2 mp -115.97 152.44 33.49 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.81 -0.811 . . . . 1.4199999999999999 108.81 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 70.5 m80 -111.04 150.54 29.19 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.645 0.259 . . . . 3.1499999999999999 111.193 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 23.2 tp -129.84 109.79 11.21 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.314 -0.403 . . . . 1.54 111.245 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 16.0 t -96.18 126.87 48.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 109.901 -0.407 . . . . 1.79 109.901 179.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 63.9 mt -74.46 112.34 10.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.947 -0.57 . . . . 2.4300000000000002 109.903 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 29.3 ttt180 -85.37 103.25 14.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.119 -0.491 . . . . 3.5 111.236 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 77.9 mt -73.77 126.25 29.95 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.007 -0.542 . . . . 2.9900000000000002 109.796 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 11.3 mmt180 -89.39 -32.25 17.37 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.89 0.376 . . . . 3.9199999999999999 111.398 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -134.06 131.95 6.2 Favored Glycine 0 N--CA 1.446 -0.691 0 C-N-CA 120.886 -0.673 . . . . 3.0800000000000001 112.028 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.706 0 CA-C-O 118.848 -0.973 . . . . 3.8199999999999998 111.532 179.84 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.67 0 N-CA-C 111.495 -0.642 . . . . 5.9900000000000002 111.495 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 4.2 m -77.76 70.5 4.14 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.437 0.637 . . . . 5.7999999999999998 110.715 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -86.34 85.73 7.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.709 -0.678 . . . . 4.29 110.272 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 5.4 m -63.04 -40.54 98.04 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.706 -0.679 . . . . 4.2199999999999998 111.193 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -109.27 108.35 60.18 Favored Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 115.93 -0.577 . . . . 2.5499999999999998 110.884 -179.354 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -64.77 141.56 72.5 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.656 2.237 . . . . 3.77 111.137 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -53.96 -41.08 67.41 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.605 0.594 . . . . 5.3600000000000003 112.605 -179.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -55.37 -52.58 63.07 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.932 0.396 . . . . 6.8899999999999997 111.72 -179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.44 -36.67 83.15 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.195 -0.457 . . . . 4.2000000000000002 110.974 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 395' ' ' ILE . . . . . . . . . . . . . 93.1 mt -63.17 -42.37 96.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.075 -0.512 . . . . 3.7999999999999998 110.317 179.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 24.1 mmtp -58.61 -41.2 85.31 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.481 -0.327 . . . . 6.5800000000000001 110.913 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -63.48 -41.71 98.57 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.151 -0.477 . . . . 7.46 110.794 179.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 77.8 mt -73.44 -27.92 61.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.056 -0.52 . . . . 4.3099999999999996 111.646 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 31.4 mmt -67.62 -41.9 83.22 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.425 -0.352 . . . . 5.7999999999999998 111.17 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -61.51 -24.39 66.57 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.118 -0.492 . . . . 7.71 111.699 -179.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 44.9 mt -68.93 -17.5 63.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 5.6900000000000004 111.0 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 90.93 34.66 7.56 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.719 -0.753 . . . . 5.8700000000000001 112.36 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -113.8 149.88 42.5 Favored Pre-proline 0 C--N 1.325 -0.47 0 N-CA-C 110.531 -0.174 . . . . 4.8399999999999999 110.531 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -67.03 142.62 62.46 Favored 'Trans proline' 0 CA--C 1.531 0.329 0 C-N-CA 122.474 2.116 . . . . 4.7199999999999998 111.9 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -65.35 -33.81 76.83 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.394 -0.366 . . . . 4.4400000000000004 111.447 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -62.56 -38.69 91.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.266 -0.424 . . . . 4.6900000000000004 110.764 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -65.34 -33.94 77.14 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.163 0.506 . . . . 3.2599999999999998 109.678 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 54.0 t -63.99 -41.73 93.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.347 -0.842 . . . . 2.1600000000000001 109.432 179.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 88.0 t -59.93 -47.57 91.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.916 -0.584 . . . . 2.8900000000000001 110.276 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 34.3 mttp -60.3 -47.5 85.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.663 -0.698 . . . . 5.5 111.079 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -67.18 -44.91 78.5 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.746 -0.661 . . . . 2.96 111.96 -178.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -63.93 -31.26 72.39 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.94 0.348 . . . . 3.4500000000000002 111.94 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 32.3 mmtt -71.58 -45.91 60.85 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.801 0.297 . . . . 5.8499999999999996 111.801 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -72.05 -27.82 62.94 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.196 0.443 . . . . 5.5300000000000002 112.196 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 39.5 p -92.4 -14.48 28.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.816 0.341 . . . . 5.4199999999999999 111.238 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 59.81 62.42 1.69 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 113.039 0.755 . . . . 6.6399999999999997 113.039 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 86.33 -12.21 61.25 Favored Glycine 0 CA--C 1.518 0.248 0 C-N-CA 120.523 -0.846 . . . . 4.3300000000000001 114.051 178.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -73.43 79.76 1.4 Allowed 'General case' 0 C--N 1.321 -0.668 0 O-C-N 122.348 -0.501 . . . . 6.4000000000000004 110.117 179.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -58.62 -42.32 87.95 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.155 -0.475 . . . . 4.3300000000000001 112.135 -179.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -65.11 -37.71 88.33 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.295 0.569 . . . . 6.9900000000000002 110.542 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -73.34 -38.16 65.86 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.659 -0.7 . . . . 7.4800000000000004 109.163 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -61.88 -42.65 99.31 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.549 -0.751 . . . . 3.8399999999999999 110.408 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -58.93 -42.11 88.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.129 0.49 . . . . 3.7999999999999998 110.09 179.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 71.6 m -70.49 -37.86 74.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.85 -0.614 . . . . 5.0499999999999998 110.867 179.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -71.38 -48.85 47.44 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 113.058 0.762 . . . . 4.3600000000000003 113.058 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.6 pp -67.3 -34.51 77.52 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.154 0.427 . . . . 3.21 112.154 -178.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 427' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -89.08 1.62 55.31 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.216 0.45 . . . . 5.2699999999999996 112.216 -179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -59.9 -19.67 52.9 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.842 0.353 . . . . 5.7699999999999996 111.698 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 41.0 m . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.244 -0.884 . . . . 5.1100000000000003 109.981 179.237 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 ptt? . . . . . 0 N--CA 1.483 1.183 0 N-CA-C 110.092 -0.336 . . . . 1.6499999999999999 110.092 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 77.1 mm-40 -107.42 138.68 43.18 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.659 0.266 . . . . 2.04 110.71 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 32.3 pt -124.15 163.64 23.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.439 -0.346 . . . . 1.48 110.092 179.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -117.65 122.79 44.52 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.787 0.327 . . . . 2.1699999999999999 110.914 -179.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 56.1 t -106.74 122.39 60.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.287 -0.415 . . . . 1.6499999999999999 109.988 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -109.52 137.33 47.52 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.197 0.523 . . . . 3.5099999999999998 111.395 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.27 159.08 16.91 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.675 -0.693 . . . . 2.1699999999999999 109.554 179.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 55.8 mt -64.57 -6.84 8.4 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.112 0.412 . . . . 3.0499999999999998 112.112 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.9 p -88.96 -10.52 47.43 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.058 0.456 . . . . 2.7000000000000002 110.338 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.47 -9.02 52.78 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.97 -0.559 . . . . 2.6400000000000001 112.19 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -68.18 143.6 55.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.873 0.368 . . . . 2.5600000000000001 111.514 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.7 m -136.3 111.6 9.11 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.457 -0.571 . . . . 2.4100000000000001 109.457 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.5 mt -112.43 148.69 15.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.534 -0.303 . . . . 1.8300000000000001 110.717 -178.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 7.9 m -96.83 142.41 28.86 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.298 -0.63 . . . . 2.1899999999999999 109.298 178.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 17.9 mt -133.41 131.19 39.68 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.843 0.354 . . . . 1.3600000000000001 111.464 179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -85.99 109.45 18.79 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.786 -0.643 . . . . 2.3999999999999999 109.316 178.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 16.8 m -134.0 -169.8 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.93 -0.577 . . . . 1.25 110.732 -179.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -153.26 153.96 30.11 Favored Pre-proline 0 C--N 1.322 -0.621 0 N-CA-C 107.408 -1.33 . . . . 1.8500000000000001 107.408 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_exo -53.64 -31.67 61.19 Favored 'Trans proline' 0 CA--C 1.528 0.199 0 C-N-CA 122.208 1.939 . . . . 1.78 112.122 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.5 1.42 22.41 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.046 0.758 . . . . 2.1200000000000001 113.046 -179.055 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -89.0 137.79 31.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.83 0.347 . . . . 1.25 110.161 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.07 154.2 24.51 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.247 -0.433 . . . . 1.77 111.084 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 34.3 mm -56.3 -41.32 70.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.369 -0.378 . . . . 1.0600000000000001 110.9 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -57.45 -37.47 72.9 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.108 -0.496 . . . . 2.2200000000000002 110.677 179.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -67.81 -32.5 73.1 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.076 -0.511 . . . . 1.3300000000000001 110.435 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 46.2 t -69.28 -40.68 80.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 108.91 -0.774 . . . . 0.67000000000000004 108.91 178.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.7 mmmm -59.03 -43.28 91.6 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.527 -0.761 . . . . 1.6899999999999999 109.871 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.01 -41.44 96.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.485 -0.78 . . . . 1.0800000000000001 110.7 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 28.4 mtmm -65.11 -36.84 85.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.008 -0.542 . . . . 1.48 110.944 179.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 81.7 mt -66.48 -38.06 80.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 109.973 -0.38 . . . . 1.3100000000000001 109.973 178.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -68.7 -31.8 71.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.036 0.446 . . . . 2.0899999999999999 110.481 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -74.64 -22.98 58.61 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.843 0.354 . . . . 2.0499999999999998 111.28 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -97.45 -43.52 7.24 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.216 0.45 . . . . 2.5099999999999998 112.216 -179.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 53.7 mm-40 -98.12 -31.27 12.2 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.131 0.789 . . . . 2.1400000000000001 113.131 -178.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 91.75 5.47 66.52 Favored Glycine 0 C--N 1.324 -0.134 0 C-N-CA 120.533 -0.841 . . . . 2.0099999999999998 112.152 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 65.7 mt -84.96 125.09 71.52 Favored Pre-proline 0 C--N 1.328 -0.362 0 N-CA-C 110.395 -0.224 . . . . 1.8300000000000001 110.395 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_exo -55.09 140.93 80.55 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.875 2.383 . . . . 2.04 111.737 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -64.1 -13.0 35.15 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.873 2.382 . . . . 1.52 112.432 -179.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.58 -23.93 53.49 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.031 -0.531 . . . . 2.9500000000000002 110.098 179.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -100.16 -15.93 17.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.85 -0.614 . . . . 2.73 110.555 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -75.84 125.05 28.35 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.96 -0.564 . . . . 1.4399999999999999 111.197 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 57.2 mtt180 -128.62 103.46 7.11 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.205 -0.452 . . . . 2.9399999999999999 109.921 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.8 mt -90.06 132.11 35.57 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.343 0.498 . . . . 1.02 112.343 -178.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 1.1 mt -120.93 141.83 39.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.646 -0.706 . . . . 2.1400000000000001 109.418 179.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -128.7 102.72 6.7 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.461 -0.336 . . . . 1.71 110.279 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 63.23 12.53 6.2 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.825 -0.625 . . . . 2.1000000000000001 112.629 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 111.15 -6.88 28.9 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.863 -0.684 . . . . 1.8400000000000001 112.09 -179.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 82.8 mttt -91.42 137.29 32.48 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.297 -0.26 . . . . 3.4300000000000002 110.297 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -76.26 123.21 25.55 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 123.432 0.457 . . . . 2.7200000000000002 110.244 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 42.8 mt -92.6 122.87 35.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.229 -0.441 . . . . 1.1699999999999999 110.864 -179.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -93.11 145.43 24.41 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.025 -0.534 . . . . 2.6499999999999999 110.205 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -58.07 -42.12 84.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 1.8300000000000001 112.197 -179.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.86 41.49 2.59 Favored Glycine 0 CA--C 1.519 0.33 0 C-N-CA 121.339 -0.458 . . . . 1.8200000000000001 114.201 -178.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -134.58 158.78 43.12 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.263 -0.643 . . . . 2.9300000000000002 109.263 179.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -100.7 155.44 17.89 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.912 -0.403 . . . . 1.71 109.912 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 92.2 mt -59.63 -38.32 81.04 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.828 0.346 . . . . 1.49 111.475 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.27 -20.31 65.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.267 -0.424 . . . . 2.1000000000000001 111.757 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -69.18 -31.91 70.85 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.818 0.342 . . . . 2.0299999999999998 110.677 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -98.08 9.86 41.83 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.195 -0.457 . . . . 1.76 111.4 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 65.02 29.36 12.22 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.952 -0.567 . . . . 3.3700000000000001 111.142 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 83.0 mt -77.47 121.09 29.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.988 -0.551 . . . . 1.6499999999999999 110.249 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -113.24 -164.35 0.91 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.588 -0.733 . . . . 2.79 110.155 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 56.9 pttt -73.64 147.53 43.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.596 0.236 . . . . 3.52 110.43 179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 64.28 28.97 13.87 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.99 0.737 . . . . 3.1200000000000001 112.99 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 50.4 m -84.38 140.81 31.31 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.577 -0.527 . . . . 1.8999999999999999 109.577 178.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -94.18 114.29 26.38 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.431 -0.35 . . . . 2.1600000000000001 111.305 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.0 mp -106.52 141.71 37.36 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.158 -0.682 . . . . 1.4199999999999999 109.158 178.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -106.74 147.21 29.9 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 111.53 0.196 . . . . 3.1499999999999999 111.53 -179.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 27.7 tp -120.8 116.33 25.01 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.095 0.474 . . . . 1.54 111.482 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -96.29 143.2 12.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.819 -0.628 . . . . 1.79 110.004 179.104 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 12.4 mt -86.49 134.92 33.63 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.172 -0.467 . . . . 2.4300000000000002 111.314 -179.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -112.48 129.94 56.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.034 -0.53 . . . . 3.5 110.359 179.303 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 5.9 mt -118.41 155.36 30.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.882 0.372 . . . . 2.9900000000000002 111.39 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 32.0 mmt180 -96.73 -52.96 3.71 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.116 -0.493 . . . . 3.9199999999999999 110.002 178.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -144.75 145.82 15.6 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.91 -0.662 . . . . 3.0800000000000001 112.082 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.885 0 N-CA-C 110.906 -0.878 . . . . 3.8199999999999998 110.906 179.76 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.871 0 N-CA-C 112.041 -0.424 . . . . 5.9900000000000002 112.041 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.08 98.27 5.71 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.807 0.337 . . . . 5.7999999999999998 110.73 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -154.06 96.55 1.97 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.264 -0.425 . . . . 4.29 111.113 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.87 0.82 42.37 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.178 0.513 . . . . 4.2199999999999998 110.45 179.212 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -107.16 101.26 37.3 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.726 -0.67 . . . . 2.5499999999999998 109.733 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -67.52 130.04 21.39 Favored 'Trans proline' 0 C--O 1.235 0.366 0 C-N-CA 122.55 2.167 . . . . 3.77 111.124 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -54.1 -39.23 66.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.164 -0.471 . . . . 5.3600000000000003 111.038 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -59.38 -51.11 71.33 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.778 -0.647 . . . . 6.8899999999999997 110.301 179.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 26.1 m -59.24 -45.25 91.67 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.907 -0.588 . . . . 4.2000000000000002 111.091 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 395' ' ' ILE . . . . . . . . . . . . . 78.3 mt -58.09 -49.02 82.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 3.7999999999999998 110.561 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 85.8 mttt -60.0 -42.26 93.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 6.5800000000000001 112.001 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 -62.87 -41.24 99.31 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.887 0.375 . . . . 7.46 110.981 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 80.8 mt -72.79 -26.49 61.54 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.083 -0.508 . . . . 4.3099999999999996 111.464 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 30.7 mmt -62.35 -40.25 95.77 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.315 -0.402 . . . . 5.7999999999999998 111.293 179.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -70.45 -17.79 62.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.865 -0.607 . . . . 7.71 112.138 -178.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 94.5 mt -69.51 -16.26 63.41 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.837 0.351 . . . . 5.6900000000000004 111.75 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 96.87 32.57 6.45 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.711 -0.757 . . . . 5.8700000000000001 112.178 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -126.4 144.58 49.86 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 110.486 -0.191 . . . . 4.8399999999999999 110.486 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -72.77 162.78 40.26 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.697 2.265 . . . . 4.7199999999999998 111.999 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 14.2 ttt180 -63.51 -28.3 69.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.835 -0.62 . . . . 4.4400000000000004 111.033 -179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -56.21 -48.88 75.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.862 -0.608 . . . . 4.6900000000000004 111.209 179.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -64.94 -35.74 82.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.824 -0.625 . . . . 3.2599999999999998 110.644 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 73.9 t -63.22 -50.54 78.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.823 -0.626 . . . . 2.1600000000000001 110.796 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 59.8 t -60.2 -44.31 95.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.502 -0.317 . . . . 2.8900000000000001 111.403 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -64.15 -50.4 68.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.296 -0.411 . . . . 5.5 111.72 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -63.54 -50.04 71.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 2.96 111.703 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -59.59 -30.45 68.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.332 -0.395 . . . . 3.4500000000000002 111.969 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 23.5 mmtt -67.35 -48.3 67.88 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.418 -0.355 . . . . 5.8499999999999996 111.128 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 23.8 pt20 -76.09 -30.96 58.48 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 113.147 0.795 . . . . 5.5300000000000002 113.147 -179.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 65.4 p -84.02 -8.14 59.21 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.007 0.432 . . . . 5.4199999999999999 110.915 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 61.96 61.1 1.42 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.366 -0.834 . . . . 6.6399999999999997 112.811 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 74.27 -23.15 1.2 Allowed Glycine 0 CA--C 1.521 0.41 0 CA-C-N 115.493 -0.776 . . . . 4.3300000000000001 114.928 178.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -68.91 113.43 6.32 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 117.868 0.834 . . . . 6.4000000000000004 111.807 -179.291 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -73.29 -20.61 60.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.942 -1.026 . . . . 4.3300000000000001 112.274 -178.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -61.93 -55.63 27.53 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.36 0.6 . . . . 6.9900000000000002 110.041 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -75.13 -24.56 58.01 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.679 -0.692 . . . . 7.4800000000000004 110.4 179.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -61.61 -46.69 88.74 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.003 -0.739 . . . . 3.8399999999999999 109.003 178.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -64.47 -38.84 92.43 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.85 -0.613 . . . . 3.7999999999999998 109.693 179.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 49.1 m -66.98 -31.3 71.77 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.049 -0.523 . . . . 5.0499999999999998 110.781 178.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.65 -49.41 10.52 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.773 0.657 . . . . 4.3600000000000003 112.773 -179.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 4.2 pp -64.88 -33.82 76.92 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 114.599 1.333 . . . . 3.21 114.599 -177.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 427' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -76.34 0.74 18.36 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 113.174 0.805 . . . . 5.2699999999999996 113.174 -178.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -50.93 -46.05 60.73 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.956 0.724 . . . . 5.7699999999999996 112.956 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 9.5 m . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.549 -0.739 . . . . 5.1100000000000003 110.361 -179.951 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 ptt? . . . . . 0 N--CA 1.481 1.09 0 CA-C-O 120.623 0.249 . . . . 1.6499999999999999 110.365 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -105.93 135.18 47.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.864 0.364 . . . . 2.04 111.753 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.1 pt -129.75 165.22 30.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 109.316 -0.624 . . . . 1.48 109.316 178.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -122.54 127.5 49.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.646 0.26 . . . . 2.1699999999999999 110.622 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 44.3 t -110.17 124.84 67.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 116.504 -0.317 . . . . 1.6499999999999999 110.331 179.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -91.71 149.63 21.52 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.417 -0.356 . . . . 3.5099999999999998 110.625 179.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.3 p -126.1 167.84 14.82 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.988 -0.551 . . . . 2.1699999999999999 109.605 179.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 33.0 mt -65.22 -23.3 67.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.067 0.461 . . . . 3.0499999999999998 110.454 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.4 -5.53 56.63 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.572 -0.74 . . . . 2.7000000000000002 111.124 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.18 30.12 57.59 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 121.051 -0.595 . . . . 2.6400000000000001 112.523 179.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.499 ' HZ3' ' CD ' ' A' ' 34' ' ' GLU . 36.5 ttpt -104.42 129.77 52.36 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 122.774 -0.251 . . . . 2.5600000000000001 110.574 179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.2 m -87.85 112.01 22.02 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.316 -0.402 . . . . 2.4100000000000001 110.388 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 49.0 mt -96.59 116.07 37.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.402 -0.363 . . . . 1.8300000000000001 110.6 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.58 126.93 32.85 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.717 -0.845 . . . . 2.1899999999999999 108.717 178.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 11.5 mt -126.96 139.2 53.21 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.988 0.736 . . . . 1.3600000000000001 112.988 -178.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -95.13 106.74 18.77 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 114.855 -1.066 . . . . 2.3999999999999999 108.716 178.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 6.4 m -140.61 171.05 13.59 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-O 120.87 0.366 . . . . 1.25 110.777 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -124.34 153.35 68.9 Favored Pre-proline 0 C--N 1.319 -0.721 0 N-CA-C 108.903 -0.777 . . . . 1.8500000000000001 108.903 178.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_exo -53.49 -35.87 77.77 Favored 'Trans proline' 0 CA--C 1.53 0.305 0 C-N-CA 122.45 2.1 . . . . 1.78 112.177 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.1 m -85.02 14.56 4.82 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.54 0.571 . . . . 2.1200000000000001 112.54 -179.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -92.61 135.69 33.86 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.213 -0.662 . . . . 1.25 109.213 178.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.45 147.79 37.68 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.269 -0.423 . . . . 1.77 111.272 -178.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 47.3 mm -56.35 -37.41 50.62 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 CA-C-N 116.48 -0.327 . . . . 1.0600000000000001 110.661 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -57.76 -40.5 79.92 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.244 -0.435 . . . . 2.2200000000000002 110.673 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -69.34 -35.13 75.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.023 -0.535 . . . . 1.3300000000000001 109.839 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 59.7 t -65.54 -41.72 91.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 109.133 -0.692 . . . . 0.67000000000000004 109.133 178.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.4 mmmm -60.98 -40.37 93.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.737 -0.665 . . . . 1.6899999999999999 109.713 178.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.47 -36.26 82.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.82 -0.627 . . . . 1.0800000000000001 110.173 179.127 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -65.74 -35.82 81.82 Favored 'General case' 0 C--N 1.334 -0.082 0 CA-C-N 116.132 -0.485 . . . . 1.48 110.112 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 79.5 mt -69.79 -38.31 75.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 108.801 -0.814 . . . . 1.3100000000000001 108.801 178.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -63.95 -30.4 71.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.529 -0.759 . . . . 2.0899999999999999 110.473 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -70.41 -17.25 63.01 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.005 -0.543 . . . . 2.0499999999999998 110.824 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -107.6 -54.34 2.5 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.105 -0.498 . . . . 2.5099999999999998 112.014 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.499 ' CD ' ' HZ3' ' A' ' 11' ' ' LYS . 23.3 mm-40 -79.12 -36.19 41.02 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 111.916 0.339 . . . . 2.1400000000000001 111.916 -178.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 94.87 -15.65 62.95 Favored Glycine 0 C--O 1.229 -0.189 0 C-N-CA 120.836 -0.697 . . . . 2.0099999999999998 112.03 -179.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 54.2 mt -69.56 126.61 92.7 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 115.905 -0.148 . . . . 1.8300000000000001 110.746 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo -58.68 145.87 94.07 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.124 2.549 . . . . 2.04 112.235 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -60.05 -21.51 65.6 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.263 2.642 . . . . 1.52 112.638 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.55 -19.76 65.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.265 -0.425 . . . . 2.9500000000000002 111.735 -179.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -114.01 9.06 17.29 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.086 0.469 . . . . 2.73 110.249 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 -98.85 108.84 21.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.622 -0.717 . . . . 1.4399999999999999 110.925 -179.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 11.1 mmt85 -104.8 104.43 14.21 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.019 0.438 . . . . 2.9399999999999999 109.866 178.524 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.9 mt -102.15 134.65 45.06 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.741 -0.663 . . . . 1.02 111.699 -178.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 10.8 pt -138.73 160.97 30.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.989 -0.55 . . . . 2.1400000000000001 110.185 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -134.91 106.24 6.77 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.423 -0.584 . . . . 1.71 109.423 179.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.92 33.42 19.87 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.086 -0.506 . . . . 2.1000000000000001 111.725 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 99.95 -31.48 8.38 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.888 -0.673 . . . . 1.8400000000000001 113.408 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -78.42 130.27 35.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.849 0.324 . . . . 3.4300000000000002 111.404 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.77 140.94 56.68 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.914 -0.585 . . . . 2.7200000000000002 110.529 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 72.0 mt -97.58 113.01 24.65 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.57 -0.286 . . . . 1.1699999999999999 110.798 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -76.87 133.06 39.41 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.282 -0.417 . . . . 2.6499999999999999 109.978 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -58.94 -29.13 66.9 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.919 -0.582 . . . . 1.8300000000000001 112.209 -179.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.53 2.16 83.36 Favored Glycine 0 CA--C 1.52 0.354 0 C-N-CA 121.055 -0.593 . . . . 1.8200000000000001 113.719 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.7 mmt180 -107.99 166.12 10.96 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.073 0.437 . . . . 2.9300000000000002 110.328 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 76.9 p -105.04 177.39 4.86 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.782 -0.451 . . . . 1.71 109.782 179.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 94.8 mt -67.19 -34.87 78.42 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.971 0.415 . . . . 1.49 109.882 179.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -27.47 68.93 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.958 -0.565 . . . . 2.1000000000000001 111.368 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -65.23 -23.34 67.04 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.908 0.385 . . . . 2.0299999999999998 111.704 -179.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -115.03 16.07 17.13 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.386 -0.37 . . . . 1.76 110.929 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 59.66 29.09 18.64 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.769 -0.651 . . . . 3.3700000000000001 111.658 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 76.7 mt -77.48 119.61 26.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.044 -0.526 . . . . 1.6499999999999999 110.335 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 15.0 mt-30 -110.96 -167.99 1.25 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.67 -0.695 . . . . 2.79 109.496 -179.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 24.0 pttt -73.3 152.73 40.84 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 121.01 -0.276 . . . . 3.52 110.412 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 70.4 -1.53 2.48 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.574 0.583 . . . . 3.1200000000000001 112.574 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 69.1 m -69.88 137.19 51.45 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 110.235 -0.283 . . . . 1.8999999999999999 110.235 179.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.4 m -96.57 120.41 36.84 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.168 0.509 . . . . 2.1600000000000001 111.713 -179.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.7 mp -98.73 156.43 16.84 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.551 -0.907 . . . . 1.4199999999999999 108.551 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 72.7 m80 -117.03 125.44 51.35 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.862 0.363 . . . . 3.1499999999999999 111.937 -179.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 47.5 tp -115.58 120.36 39.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.921 -0.582 . . . . 1.54 110.521 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.2 t -112.74 138.89 40.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.005 -0.543 . . . . 1.79 110.678 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.8 mt -72.05 122.82 21.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.84 -0.618 . . . . 2.4300000000000002 110.343 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 59.3 ttt180 -89.92 104.5 17.06 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.29 -0.414 . . . . 3.5 110.553 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.4 mp -69.29 113.35 6.55 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.909 -0.587 . . . . 2.9900000000000002 110.546 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 8.6 mmt85 -82.81 -19.49 37.58 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.05 -0.523 . . . . 3.9199999999999999 110.317 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -163.27 151.32 20.89 Favored Glycine 0 N--CA 1.443 -0.894 0 N-CA-C 111.258 -0.737 . . . . 3.0800000000000001 111.258 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.586 -1.119 . . . . 3.8199999999999998 111.651 -179.987 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.655 0 N-CA-C 111.553 -0.619 . . . . 5.9900000000000002 111.553 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 2.3 m -124.9 36.5 4.59 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.083 0.468 . . . . 5.7999999999999998 110.473 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -104.02 109.36 21.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.146 -0.479 . . . . 4.29 110.614 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.74 -14.49 51.46 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.336 0.589 . . . . 4.2199999999999998 110.547 179.339 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -99.34 111.31 60.94 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.633 -0.712 . . . . 2.5499999999999998 110.423 -179.694 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_exo -71.42 136.27 28.33 Favored 'Trans proline' 0 C--O 1.237 0.434 0 C-N-CA 122.792 2.328 . . . . 3.77 111.44 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.75 -36.14 69.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.231 -0.441 . . . . 5.3600000000000003 112.066 -179.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -56.79 -52.89 63.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.045 0.45 . . . . 6.8899999999999997 110.9 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -67.47 -36.24 80.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.886 -0.597 . . . . 4.2000000000000002 110.948 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 395' ' ' ILE . . . . . . . . . . . . . 74.1 mt -59.59 -52.28 62.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.058 -0.519 . . . . 3.7999999999999998 110.224 179.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 31.8 mttp -56.29 -42.7 77.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.355 -0.384 . . . . 6.5800000000000001 111.445 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -61.95 -39.01 90.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.276 -0.42 . . . . 7.46 111.23 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 90.4 mt -76.71 -31.67 57.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.401 -0.363 . . . . 4.3099999999999996 111.316 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 35.0 mmt -66.97 -39.96 87.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.075 0.464 . . . . 5.7999999999999998 110.0 179.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -62.38 -28.26 69.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.572 -0.74 . . . . 7.71 111.975 -179.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 38.2 mt -63.69 -26.83 68.84 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.071 0.462 . . . . 5.6900000000000004 110.59 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 111.61 27.1 4.23 Favored Glycine 0 N--CA 1.446 -0.638 0 N-CA-C 111.483 -0.647 . . . . 5.8700000000000001 111.483 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -113.08 143.21 28.72 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-O 120.652 0.263 . . . . 4.8399999999999999 110.91 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.88 164.62 31.45 Favored 'Trans proline' 0 C--O 1.236 0.418 0 C-N-CA 123.022 2.481 . . . . 4.7199999999999998 112.949 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -64.12 -28.26 69.65 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.796 -0.638 . . . . 4.4400000000000004 111.408 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 406' ' ' ASP . . . . . 0.427 ' CG ' ' HZ3' ' B' ' 410' ' ' LYS . 33.4 t70 -63.32 -37.71 88.33 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.011 0.434 . . . . 4.6900000000000004 110.448 179.19 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -68.56 -45.19 72.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.8 -0.637 . . . . 3.2599999999999998 111.453 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 14.6 p -63.22 -41.23 92.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 N-CA-C 112.091 0.404 . . . . 2.1600000000000001 112.091 -179.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 74.7 t -64.23 -50.23 77.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.902 0.382 . . . . 2.8900000000000001 111.143 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 410' ' ' LYS . . . . . 0.427 ' HZ3' ' CG ' ' B' ' 406' ' ' ASP . 65.9 mttt -62.85 -40.52 97.69 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.295 -0.411 . . . . 5.5 111.706 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -67.89 -45.43 74.47 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.296 -0.411 . . . . 2.96 110.979 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -61.26 -33.72 74.0 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.198 -0.456 . . . . 3.4500000000000002 111.543 -179.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 42.3 mmtt -69.76 -50.81 39.67 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.121 0.415 . . . . 5.8499999999999996 112.121 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -70.29 -23.83 62.93 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 113.17 0.804 . . . . 5.5300000000000002 113.17 -178.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 68.6 p -99.01 -5.02 31.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.005 0.431 . . . . 5.4199999999999999 110.973 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 57.76 61.72 2.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.494 -0.775 . . . . 6.6399999999999997 112.96 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 76.92 -14.46 7.46 Favored Glycine 0 CA--C 1.519 0.314 0 N-CA-C 114.902 0.721 . . . . 4.3300000000000001 114.902 177.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -71.32 94.16 1.19 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 117.733 0.767 . . . . 6.4000000000000004 110.166 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -61.79 -33.34 73.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.089 -0.505 . . . . 4.3300000000000001 111.853 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -65.91 -43.43 88.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.238 0.542 . . . . 6.9900000000000002 109.628 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.53 -36.99 65.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.701 -0.681 . . . . 7.4800000000000004 109.6 179.211 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -59.28 -47.02 86.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.834 -0.621 . . . . 3.8399999999999999 110.529 179.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -60.23 -46.31 90.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.154 -0.475 . . . . 3.7999999999999998 110.436 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 61.3 m -65.38 -29.18 69.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.201 -0.454 . . . . 5.0499999999999998 111.519 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -80.69 -49.71 10.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.416 -0.356 . . . . 4.3600000000000003 111.947 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 4.2 pp -64.09 -33.03 74.84 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.927 0.343 . . . . 3.21 111.927 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 427' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -63.07 -11.03 16.79 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.772 0.656 . . . . 5.2699999999999996 112.772 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -67.05 -20.55 65.86 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.764 0.316 . . . . 5.7699999999999996 110.943 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 1.6 m . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.775 -0.631 . . . . 5.1100000000000003 110.741 179.984 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.483 ' HB2' ' HB3' ' A' ' 63' ' ' LYS . 22.7 ptt? . . . . . 0 N--CA 1.484 1.251 0 N-CA-C 110.463 -0.199 . . . . 1.65 110.463 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 55.0 mm-40 -109.4 143.06 39.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.468 0.175 . . . . 1.92 110.764 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 25.0 pt -128.7 162.83 34.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.473 -0.331 . . . . 1.48 110.535 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -118.34 112.23 19.77 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.429 -0.35 . . . . 2.17 110.921 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.82 ' HB ' ' HB ' ' A' ' 13' ' ' ILE . 25.1 t -98.86 114.58 37.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.298 -0.41 . . . . 1.65 110.602 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -86.91 125.91 34.34 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.29 -0.414 . . . . 3.16 111.132 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.17 162.15 13.49 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.045 -0.525 . . . . 2.17 109.797 179.376 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 85.5 mt -64.56 -11.03 30.3 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 112.235 0.457 . . . . 3.05 112.235 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.25 11.94 34.68 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.217 -0.447 . . . . 2.7 111.077 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.16 28.27 70.47 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 121.195 -0.526 . . . . 2.64 112.641 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -101.26 143.84 30.84 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 110.511 -0.181 . . . . 2.34 110.511 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.6 m -107.46 105.04 14.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.055 0.455 . . . . 2.31 110.858 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.82 ' HB ' ' HB ' ' A' ' 5' ' ' VAL . 70.9 mt -86.1 114.44 25.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.86 -0.609 . . . . 1.83 109.891 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.7 m -96.33 113.69 25.3 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.739 -0.467 . . . . 2.02 109.739 179.502 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.445 ' HG ' HG22 ' A' ' 13' ' ' ILE . 56.6 mt -122.64 156.63 33.92 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.97 0.414 . . . . 1.33 111.732 -179.195 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -101.01 119.36 38.63 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.458 -0.792 . . . . 2.4 109.685 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.418 ' O ' ' HG2' ' A' ' 1' ' ' MET . 13.2 m -142.22 -171.86 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 116.101 -0.5 . . . . 1.25 110.042 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.407 ' O ' HD12 ' A' ' 56' ' ' LEU . 25.5 mm-40 -152.55 156.32 33.26 Favored Pre-proline 0 C--N 1.322 -0.604 0 N-CA-C 107.903 -1.147 . . . . 1.85 107.903 179.002 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.47 ' HA ' ' HB2' ' A' ' 56' ' ' LEU . 73.4 Cg_exo -51.89 -35.16 58.79 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 122.422 2.081 . . . . 1.78 112.003 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.8 m -75.06 8.33 2.65 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.931 0.715 . . . . 1.8 112.931 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -92.41 147.96 22.49 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 122.187 -0.321 . . . . 1.23 110.451 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.8 OUTLIER -93.96 152.04 19.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.317 -0.401 . . . . 1.44 110.652 -179.515 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.433 ' HB ' ' HA ' ' A' ' 52' ' ' ASP . 49.8 mm -58.05 -43.17 84.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.398 -0.364 . . . . 0.99 110.411 179.642 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.619 ' HG3' ' HB3' ' A' ' 52' ' ' ASP . 37.7 mt-10 -57.88 -37.59 74.24 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.107 -0.497 . . . . 2.22 110.861 179.051 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.485 ' O ' ' HG3' ' A' ' 29' ' ' LYS . 56.2 t30 -72.67 -37.26 67.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.34 -0.391 . . . . 1.23 110.594 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 92.7 t -63.51 -46.95 93.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.199 -0.455 . . . . 0.64 110.016 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.4 mtmt -64.51 -31.87 73.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.11 -0.496 . . . . 1.32 110.72 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.62 -36.61 83.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.165 -0.47 . . . . 1.08 110.082 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 69.1 mttt -68.7 -40.34 80.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.986 -0.552 . . . . 1.08 109.744 179.216 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 50.3 mt -66.67 -38.96 82.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.991 -0.55 . . . . 1.31 109.586 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.29 -36.53 80.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.396 -0.82 . . . . 1.93 111.922 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -72.2 -38.77 68.98 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.811 0.671 . . . . 2.05 112.811 -178.603 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -87.03 -43.93 11.96 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 113.208 0.818 . . . . 2.17 113.208 -178.513 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -82.67 -22.2 34.68 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.707 0.632 . . . . 2.14 112.707 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 73.92 26.36 69.22 Favored Glycine 0 CA--C 1.517 0.197 0 C-N-CA 120.694 -0.765 . . . . 2.01 112.279 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 80.2 mt -108.12 128.28 26.03 Favored Pre-proline 0 C--N 1.326 -0.449 0 N-CA-C 110.106 -0.331 . . . . 1.83 110.106 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -55.21 132.78 54.31 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.908 2.405 . . . . 2.04 111.999 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -57.91 -22.59 55.14 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 123.031 2.487 . . . . 1.52 112.92 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.62 -29.56 67.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.766 0.317 . . . . 2.95 111.412 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -94.16 -3.79 50.3 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.288 -0.414 . . . . 2.56 110.534 -179.617 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -86.48 107.89 18.28 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.959 -0.564 . . . . 1.4 111.5 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.461 ' HB3' ' CE2' ' B' ' 427' ' ' PHE . 12.0 mmt85 -109.76 109.01 19.57 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.221 -0.659 . . . . 2.65 109.221 178.467 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.48 ' HB3' HD12 ' A' ' 50' ' ' LEU . 30.9 mt -87.07 136.61 32.86 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.016 0.436 . . . . 1.02 112.159 -179.073 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.723 HD11 HG23 ' A' ' 70' ' ' VAL . 1.1 mt -122.41 145.09 29.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.688 -0.687 . . . . 2.14 110.298 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.441 ' CB ' HD21 ' A' ' 50' ' ' LEU . 46.2 t80 -133.92 97.33 3.86 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.952 -0.567 . . . . 1.71 109.507 178.449 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 61.35 40.98 13.6 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.764 -0.653 . . . . 2.1 111.99 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.12 -5.94 84.17 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 120.949 -0.643 . . . . 1.84 113.775 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -103.36 136.27 43.42 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.858 0.329 . . . . 3.05 110.545 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.452 ' OE1' ' HD2' ' A' ' 42' ' ' ARG . 5.9 tt0 -78.61 136.42 37.5 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.618 0.247 . . . . 2.3 110.408 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.48 HD12 ' HB3' ' A' ' 43' ' ' LEU . 71.4 mt -93.88 137.25 33.31 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.916 0.389 . . . . 1.17 111.383 -179.599 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.598 ' HB2' ' HG2' ' A' ' 54' ' ' ARG . 3.3 mt-10 -87.9 132.21 34.29 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.116 -0.493 . . . . 2.65 109.731 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.619 ' HB3' ' HG3' ' A' ' 24' ' ' GLU . 4.1 m-20 -59.37 -32.07 69.79 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 112.906 0.706 . . . . 1.83 112.906 -179.106 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -87.71 33.12 4.03 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.762 -0.732 . . . . 1.82 113.697 -179.266 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.598 ' HG2' ' HB2' ' A' ' 51' ' ' GLU . 24.4 mmt180 -131.46 171.33 13.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.809 0.337 . . . . 2.69 110.339 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 22' ' ' THR . 67.6 p -109.09 168.61 9.24 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.285 -0.635 . . . . 1.71 109.285 179.091 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.47 ' HB2' ' HA ' ' A' ' 19' ' ' PRO . 65.8 mt -66.88 -29.23 69.08 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.98 0.419 . . . . 1.49 110.139 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.78 -25.87 65.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.959 -0.564 . . . . 1.94 111.226 179.303 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -62.99 -26.76 69.01 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.39 -0.368 . . . . 2.03 111.658 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.463 ' HB2' HG13 ' A' ' 61' ' ' ILE . 70.7 m-85 -112.7 9.03 19.17 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.26 -0.427 . . . . 1.76 109.999 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 58.24 39.39 25.77 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.436 -0.802 . . . . 2.96 111.314 -179.186 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.463 HG13 ' HB2' ' A' ' 59' ' ' TYR . 78.0 mt -76.0 109.94 10.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.807 -0.633 . . . . 1.65 110.046 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -99.0 -172.42 2.28 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.85 -0.614 . . . . 2.66 111.186 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.483 ' HB3' ' HB2' ' A' ' 1' ' ' MET . 52.8 pttt -68.6 151.01 47.32 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.246 -0.434 . . . . 3.22 112.077 -179.554 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 65.54 22.08 11.78 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.367 -0.833 . . . . 3.12 112.98 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.3 m -87.83 145.7 25.95 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.741 0.305 . . . . 1.83 110.299 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.2 m -95.36 128.51 42.27 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.145 -0.479 . . . . 2.03 111.597 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LEU . . . . . 0.425 ' O ' ' HA ' ' A' ' 5' ' ' VAL . 6.8 mp -119.48 143.59 47.45 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.422 -0.955 . . . . 1.41 108.422 178.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.614 ' HB2' ' HB ' ' A' ' 44' ' ' ILE . 46.9 m80 -105.33 149.22 26.25 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 120.534 0.207 . . . . 2.76 110.729 -179.089 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 54.8 tp -126.76 111.09 13.83 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.064 0.459 . . . . 1.54 111.512 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.723 HG23 HD11 ' A' ' 44' ' ' ILE . 4.5 t -101.09 129.4 52.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.978 -0.555 . . . . 1.79 110.076 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.8 mt -86.18 97.14 10.18 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.063 -0.517 . . . . 2.43 109.649 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.41 ' HA ' ' OG ' ' B' ' 424' ' ' SER . 55.3 ttt-85 -89.62 106.28 18.35 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.098 0.475 . . . . 3.19 111.17 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 57.1 mt -84.75 -169.22 2.53 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.738 -0.664 . . . . 2.99 110.207 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 74' ' ' ARG . 17.1 mmt180 . . . . . 0 C--N 1.323 -0.566 0 N-CA-C 110.012 -0.366 . . . . 3.67 110.012 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 390' ' ' PHE . . . . . 0.508 ' HB2' HD11 ' B' ' 395' ' ' ILE . 2.1 m-85 . . . . . 0 C--O 1.233 0.201 0 N-CA-C 110.095 -0.335 . . . . 2.51 110.095 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 391' ' ' PRO . . . . . 0.464 ' O ' HG13 ' B' ' 395' ' ' ILE . 21.2 Cg_exo -66.14 125.74 14.6 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.894 2.396 . . . . 3.77 111.419 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 392' ' ' GLU . . . . . 0.514 ' HG2' ' HE3' ' B' ' 396' ' ' LYS . 40.5 tt0 -52.68 -49.39 65.37 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 112.499 0.555 . . . . 5.36 112.499 -178.778 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -53.55 -52.87 58.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 6.89 111.655 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 394' ' ' THR . . . . . 0.405 ' OG1' ' HB2' ' B' ' 391' ' ' PRO . 0.3 OUTLIER -66.08 -36.55 83.48 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.622 0.601 . . . . 4.2 112.622 -178.652 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 395' ' ' ILE . . . . . 0.508 HD11 ' HB2' ' B' ' 390' ' ' PHE . 89.1 mt -58.3 -48.84 83.83 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 N-CA-C 109.585 -0.524 . . . . 3.8 109.585 178.814 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 396' ' ' LYS . . . . . 0.514 ' HE3' ' HG2' ' B' ' 392' ' ' GLU . 95.3 mttt -62.98 -40.14 96.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.603 -0.726 . . . . 6.27 110.641 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 397' ' ' GLN . . . . . 0.492 ' O ' ' HG ' ' B' ' 401' ' ' LEU . 12.3 mm-40 -62.5 -47.7 82.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.16 -0.473 . . . . 6.91 110.983 179.321 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 398' ' ' LEU . . . . . 0.464 HD11 ' HB1' ' B' ' 419' ' ' ALA . 95.4 mt -64.8 -41.97 95.4 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.354 -0.384 . . . . 4.31 111.548 -179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 57.7 mtp -69.55 -31.6 69.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.895 0.379 . . . . 5.8 111.406 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -66.01 -18.84 65.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.943 -0.571 . . . . 7.71 111.381 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 401' ' ' LEU . . . . . 0.601 ' HA ' ' CD2' ' A' ' 68' ' ' HIS . 16.8 mt -78.51 2.28 19.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.971 -0.559 . . . . 5.69 110.933 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 93.2 41.12 4.65 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.927 -0.654 . . . . 5.87 111.844 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 403' ' ' PHE . . . . . 0.462 ' HE2' HD13 ' A' ' 44' ' ' ILE . 74.4 m-85 -132.1 146.18 60.57 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 120.524 0.202 . . . . 4.83 110.462 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -79.43 164.2 24.04 Favored 'Trans proline' 0 C--O 1.234 0.276 0 C-N-CA 122.479 2.119 . . . . 4.72 111.638 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' B' ' 405' ' ' ARG . 14.5 ttt85 -64.91 -29.21 70.14 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.337 -0.392 . . . . 4.16 110.809 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -58.51 -44.12 89.38 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.819 -0.628 . . . . 4.69 110.978 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -66.34 -38.48 87.74 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.656 -0.702 . . . . 2.99 110.476 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 67.9 t -64.01 -50.98 74.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.636 -0.711 . . . . 2.06 110.985 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 86.2 t -56.99 -51.1 73.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 112.219 0.451 . . . . 2.89 112.219 -179.144 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 78.9 mttt -64.68 -44.68 89.57 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 112.254 0.465 . . . . 5.05 112.254 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -65.09 -38.43 90.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.841 0.353 . . . . 2.96 110.587 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.71 -35.99 73.01 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.059 -0.519 . . . . 3.45 110.476 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? -60.23 -38.16 82.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.062 -0.517 . . . . 5.52 111.674 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -87.4 -7.43 57.72 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.962 0.727 . . . . 5.53 112.962 -179.361 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 16.2 p -108.46 -30.56 8.22 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.214 0.45 . . . . 5.42 112.214 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 70.09 63.56 0.23 Allowed 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 114.123 1.157 . . . . 6.37 114.123 179.025 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 89.67 -26.78 8.79 Favored Glycine 0 C--N 1.32 -0.313 0 N-CA-C 115.569 0.988 . . . . 4.33 115.569 176.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 418' ' ' ASN . . . . . 0.455 ' HB2' ' HD2' ' B' ' 421' ' ' PHE . 0.0 OUTLIER -80.05 80.3 6.48 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 118.197 0.998 . . . . 6.25 110.361 179.476 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 419' ' ' ALA . . . . . 0.464 ' HB1' HD11 ' B' ' 398' ' ' LEU . . . -59.78 -27.05 66.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.98 -1.009 . . . . 4.12 112.125 -178.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -62.46 -41.73 98.97 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.238 -1.023 . . . . 6.99 108.238 178.58 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 421' ' ' PHE . . . . . 0.455 ' HD2' ' HB2' ' B' ' 418' ' ' ASN . 44.7 m-85 -76.98 -30.69 56.07 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.243 -0.89 . . . . 7.48 109.319 178.683 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 422' ' ' ALA . . . . . 0.437 ' HB3' ' HA ' ' B' ' 419' ' ' ALA . . . -62.95 -43.81 97.78 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.935 -0.575 . . . . 3.68 109.715 178.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.464 ' HA ' ' HG ' ' B' ' 426' ' ' LEU . . . -63.89 -39.23 93.7 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.15 -0.685 . . . . 3.8 109.15 178.705 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 424' ' ' SER . . . . . 0.41 ' OG ' ' HA ' ' A' ' 72' ' ' ARG . 50.9 m -62.95 -30.89 71.92 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.623 -0.717 . . . . 5.05 110.373 178.342 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 425' ' ' LEU . . . . . 0.65 ' O ' ' HG2' ' B' ' 428' ' ' GLN . 2.8 mm? -81.18 -49.62 10.58 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 115.808 -0.633 . . . . 4.36 111.77 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 426' ' ' LEU . . . . . 0.464 ' HG ' ' HA ' ' B' ' 423' ' ' ALA . 4.4 pp -64.22 -33.72 76.44 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.728 0.64 . . . . 3.21 112.728 -179.503 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 427' ' ' PHE . . . . . 0.598 ' CZ ' HG12 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -75.86 -1.4 25.11 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 113.878 1.066 . . . . 5.27 113.878 -178.697 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 428' ' ' GLN . . . . . 0.65 ' HG2' ' O ' ' B' ' 425' ' ' LEU . 3.7 pt20 -89.7 11.31 20.27 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.105 0.479 . . . . 5.32 111.258 179.325 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 C--O 1.248 1.025 0 CA-C-N 116.054 -0.521 . . . . 5.11 110.61 179.546 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.587 ' HB2' ' HB3' ' A' ' 63' ' ' LYS . 25.9 ptt? . . . . . 0 N--CA 1.481 1.076 0 CA-C-O 120.618 0.246 . . . . 1.65 110.664 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 75.3 mm-40 -99.28 134.4 42.19 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.763 0.316 . . . . 1.92 110.908 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 23.3 pt -127.53 155.8 38.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.315 -0.402 . . . . 1.48 110.087 178.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -116.9 124.56 49.75 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.404 -0.362 . . . . 2.17 110.454 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.3 t -111.21 123.49 67.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 110.108 -0.33 . . . . 1.65 110.108 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -104.31 139.95 38.56 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.446 -0.343 . . . . 3.16 110.922 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.478 ' OG1' ' HB3' ' A' ' 11' ' ' LYS . 6.4 p -107.26 174.21 5.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.345 -0.388 . . . . 2.17 110.79 179.243 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.585 HD11 ' HB1' ' B' ' 423' ' ' ALA . 1.2 mt -58.81 -33.55 70.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.86 -0.609 . . . . 3.05 112.086 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.91 -3.2 47.08 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.039 0.385 . . . . 2.7 112.039 -179.118 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.91 8.17 69.75 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.755 -0.736 . . . . 2.64 112.252 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.478 ' HB3' ' OG1' ' A' ' 7' ' ' THR . 77.4 tttt -79.66 121.96 25.94 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.72 -0.474 . . . . 2.34 109.72 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.8 m -103.65 128.12 51.01 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.917 0.389 . . . . 2.31 111.185 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 18.4 mt -115.17 143.41 25.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 109.685 -0.487 . . . . 1.83 109.685 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.5 m -111.96 125.6 54.24 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.652 0.263 . . . . 2.02 110.306 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.8 mp -127.01 142.57 51.52 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.277 -0.419 . . . . 1.33 110.916 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -99.19 106.2 18.33 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 116.078 -0.51 . . . . 2.4 109.967 179.079 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.427 ' O ' ' HG2' ' A' ' 1' ' ' MET . 7.0 m -134.16 164.08 35.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 109.307 -0.627 . . . . 1.25 109.307 179.804 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.481 ' HA ' ' OE1' ' A' ' 18' ' ' GLU . 5.9 mm-40 -104.92 155.34 37.72 Favored Pre-proline 0 C--N 1.32 -0.689 0 C-N-CA 121.106 -0.238 . . . . 1.85 110.439 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_exo -58.12 -17.43 31.76 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.991 2.461 . . . . 1.78 113.008 -179.372 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.1 -1.75 58.24 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.514 -0.312 . . . . 1.8 111.804 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -79.32 142.56 35.98 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.902 0.382 . . . . 1.23 111.032 -179.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.6 m -81.59 146.79 29.93 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.784 -0.644 . . . . 1.44 110.269 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.406 HG12 ' O ' ' A' ' 54' ' ' ARG . 43.0 mm -53.07 -44.97 52.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 O-C-N 123.202 0.314 . . . . 0.99 111.585 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -58.35 -41.22 84.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.481 -0.327 . . . . 2.22 111.527 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -63.45 -36.42 83.7 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.992 0.425 . . . . 1.23 110.383 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.402 ' O ' HG13 ' A' ' 30' ' ' ILE . 58.1 t -67.1 -42.61 88.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.989 -0.55 . . . . 0.64 109.572 178.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 27.3 mtmt -63.31 -37.38 87.04 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.207 -0.451 . . . . 1.32 110.37 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.86 -37.38 84.31 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.097 -0.501 . . . . 1.08 109.844 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -68.49 -34.21 75.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.793 -0.639 . . . . 1.08 110.143 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.402 HG13 ' O ' ' A' ' 26' ' ' VAL . 70.9 mt -70.63 -32.85 50.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 108.97 -0.752 . . . . 1.31 108.97 178.59 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -66.31 -32.89 74.57 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.484 -0.78 . . . . 1.93 109.383 178.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -71.79 -42.92 66.52 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.456 -0.793 . . . . 2.05 109.705 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -66.82 -59.66 3.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.675 -0.693 . . . . 2.17 112.186 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -92.0 -65.27 1.02 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.197 -0.456 . . . . 2.14 112.179 -178.344 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 133.54 0.72 4.0 Favored Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.323 -0.941 . . . . 2.01 112.652 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 16.7 mt -67.83 125.1 90.91 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 110.144 -0.317 . . . . 1.83 110.144 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.423 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 52.4 Cg_exo -54.84 135.89 69.77 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.73 2.286 . . . . 2.04 111.423 179.6 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 37' ' ' PRO . 75.6 Cg_exo -51.54 -30.58 36.29 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 123.271 2.647 . . . . 1.52 113.438 -179.541 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -70.16 -29.69 66.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.162 0.506 . . . . 2.95 111.584 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -89.0 -4.46 58.42 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.342 -0.39 . . . . 2.56 110.289 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -92.85 111.82 23.56 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.797 -0.638 . . . . 1.4 111.173 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.497 ' HB3' ' CZ ' ' B' ' 427' ' ' PHE . 0.9 OUTLIER -125.07 104.3 8.47 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 108.618 -0.882 . . . . 2.65 108.618 178.713 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.471 ' HB3' HD12 ' A' ' 50' ' ' LEU . 82.8 mt -81.99 138.09 34.98 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.9 0.704 . . . . 1.02 112.9 -178.088 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 65.8 mt -124.09 134.96 65.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.265 -0.88 . . . . 2.14 109.732 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.47 ' HE1' ' HB3' ' A' ' 65' ' ' SER . 57.3 t80 -124.19 107.16 10.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.446 -0.343 . . . . 1.71 110.274 179.239 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.33 35.1 23.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.882 -0.599 . . . . 2.1 112.108 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.562 ' HA2' ' HA3' ' B' ' 402' ' ' GLY . . . 92.71 -13.48 67.38 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 120.909 -0.662 . . . . 1.84 112.924 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.3 mttt -90.44 142.12 28.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.657 0.228 . . . . 3.05 110.807 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.418 HE22 ' HZ ' ' B' ' 427' ' ' PHE . 40.9 tp60 -83.61 135.76 34.49 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 110.025 -0.361 . . . . 2.3 110.025 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.471 HD12 ' HB3' ' A' ' 43' ' ' LEU . 40.7 mt -97.58 135.85 38.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.717 0.294 . . . . 1.17 110.943 -179.634 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.419 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 31.7 tt0 -96.51 138.48 34.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.007 0.432 . . . . 2.65 111.078 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.25 -26.49 66.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.63 -0.713 . . . . 1.83 112.527 -179.584 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.419 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -87.75 11.21 67.2 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.736 -0.745 . . . . 1.82 114.043 -178.727 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.427 HH11 ' HD3' ' A' ' 54' ' ' ARG . 41.9 mmt-85 -117.79 164.07 15.56 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 117.26 0.53 . . . . 2.69 111.11 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 61.1 p -102.05 171.83 7.27 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.175 -0.466 . . . . 1.71 110.202 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 84.0 mt -63.95 -33.72 76.36 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.105 0.479 . . . . 1.49 110.528 179.051 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 67.4 m -70.03 -23.94 63.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.921 -0.581 . . . . 1.94 111.332 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -67.25 -20.21 65.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.397 -0.365 . . . . 2.03 111.758 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -114.66 12.57 17.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.105 -0.498 . . . . 1.76 110.735 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.0 m-20 58.49 37.86 25.56 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.667 -0.697 . . . . 2.96 111.625 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 86.9 mt -82.76 120.5 34.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.123 -0.49 . . . . 1.65 110.112 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -106.33 -167.69 1.33 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.943 -0.571 . . . . 2.66 109.975 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.587 ' HB3' ' HB2' ' A' ' 1' ' ' MET . 10.0 pttp -76.45 150.79 36.66 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 121.116 -0.233 . . . . 3.22 110.629 179.637 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 70.99 14.16 6.87 Favored 'General case' 0 C--O 1.235 0.29 0 O-C-N 123.654 0.597 . . . . 3.12 112.155 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.47 ' HB3' ' HE1' ' A' ' 45' ' ' PHE . 35.5 m -79.0 149.66 32.16 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.301 -0.409 . . . . 1.83 109.976 178.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -105.04 124.69 49.97 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.117 -0.492 . . . . 2.03 111.059 -179.24 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.0 mp -110.8 138.5 47.12 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.993 -0.743 . . . . 1.41 108.993 179.136 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 65.3 m80 -103.31 136.96 42.1 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.711 0.291 . . . . 2.76 111.587 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 48.5 tp -123.59 102.3 7.78 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.993 -0.548 . . . . 1.54 109.96 179.477 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.705 ' HB ' ' CE2' ' B' ' 427' ' ' PHE . 16.5 t -92.21 135.65 26.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.041 -0.527 . . . . 1.79 109.792 179.846 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.567 ' H ' HD12 ' A' ' 8' ' ' LEU . 65.6 mt -83.22 124.62 30.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.374 -0.375 . . . . 2.43 111.452 -179.203 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 38.1 ttt180 -118.67 99.11 6.58 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.891 -0.595 . . . . 3.19 110.836 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 89.0 mt -72.42 167.44 20.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.025 -0.534 . . . . 2.99 110.457 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.472 ' HD3' ' HA ' ' A' ' 74' ' ' ARG . 0.3 OUTLIER . . . . . 0 C--N 1.323 -0.57 0 CA-C-O 120.859 0.361 . . . . 3.67 111.204 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 . . . . . 0 N--CA 1.452 -0.349 0 N-CA-C 109.931 -0.396 . . . . 2.51 109.931 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo -64.91 132.42 32.3 Favored 'Trans proline' 0 C--O 1.236 0.404 0 C-N-CA 122.667 2.244 . . . . 3.77 111.606 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -51.77 -45.26 63.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.734 -0.666 . . . . 5.36 112.678 -178.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -54.5 -48.62 71.66 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.235 0.457 . . . . 6.89 112.235 -179.193 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.54 -39.17 93.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.286 -0.416 . . . . 4.2 110.898 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 395' ' ' ILE . . . . . 0.47 ' O ' ' HG2' ' B' ' 399' ' ' MET . 83.0 mt -62.73 -42.0 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.117 0 CA-C-N 116.19 -0.459 . . . . 3.8 110.197 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -57.18 -43.71 82.9 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.186 -0.461 . . . . 6.27 111.382 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 8.8 tp60 -65.8 -41.6 91.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.021 0.438 . . . . 6.91 110.808 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 92.8 mt -67.74 -34.94 77.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 4.31 111.908 -179.604 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 399' ' ' MET . . . . . 0.47 ' HG2' ' O ' ' B' ' 395' ' ' ILE . 31.5 mmt -67.27 -33.78 76.04 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.979 0.418 . . . . 5.8 110.172 179.638 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -61.58 -27.2 68.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.527 -0.76 . . . . 7.71 111.697 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 401' ' ' LEU . . . . . 0.42 HD22 HG22 ' A' ' 70' ' ' VAL . 30.9 mt -74.3 -6.45 48.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.12 -0.491 . . . . 5.69 112.155 -179.332 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 402' ' ' GLY . . . . . 0.562 ' HA3' ' HA2' ' A' ' 47' ' ' GLY . . . 85.53 46.36 5.51 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.609 -0.805 . . . . 5.87 112.384 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 403' ' ' PHE . . . . . 0.409 ' HA ' ' HD3' ' B' ' 404' ' ' PRO . 24.6 m-85 -125.64 156.98 70.03 Favored Pre-proline 0 C--N 1.329 -0.285 0 C-N-CA 122.205 0.202 . . . . 4.83 110.577 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 404' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' B' ' 403' ' ' PHE . 2.0 Cg_endo -84.65 146.31 10.63 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.864 2.376 . . . . 4.72 111.084 178.476 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.411 ' HA ' ' HE1' ' B' ' 399' ' ' MET . 37.4 ttt180 -63.58 -32.24 73.64 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.784 0.29 . . . . 4.16 111.784 -179.419 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -57.24 -40.07 76.85 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.154 0.502 . . . . 4.69 110.719 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -69.79 -36.69 75.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.759 -0.655 . . . . 2.99 109.931 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 49.7 t -63.24 -44.11 99.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.655 -0.702 . . . . 2.06 110.272 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 74.1 t -56.52 -49.09 79.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.002 -0.544 . . . . 2.89 109.877 179.111 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 51.4 mttp -63.82 -47.99 78.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.789 -0.641 . . . . 5.05 110.822 179.503 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 411' ' ' ALA . . . . . 0.41 ' HB1' ' HB1' ' B' ' 422' ' ' ALA . . . -57.32 -51.04 71.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.807 -0.633 . . . . 2.96 112.563 -178.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 5.2 mp -68.78 -31.33 70.28 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.459 0.541 . . . . 3.45 112.459 -179.01 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 8.8 mmtt -69.29 -41.56 76.66 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.083 0.401 . . . . 5.52 112.083 -179.589 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -81.15 -8.57 59.79 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.7 0.63 . . . . 5.53 112.7 -179.187 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 415' ' ' THR . . . . . 0.435 ' HB ' ' HB3' ' B' ' 418' ' ' ASN . 40.9 p -113.3 -4.83 13.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.792 0.329 . . . . 5.42 110.961 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 56.3 m-20 63.59 58.25 1.34 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.756 -0.656 . . . . 6.37 111.933 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 69.69 8.25 59.98 Favored Glycine 0 C--O 1.229 -0.178 0 CA-C-N 115.616 -0.72 . . . . 4.33 114.089 178.298 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 418' ' ' ASN . . . . . 0.435 ' HB3' ' HB ' ' B' ' 415' ' ' THR . 9.3 t-20 -76.99 82.98 3.51 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 122.324 -0.515 . . . . 6.25 109.734 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -48.16 -47.8 34.77 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 113.61 0.967 . . . . 4.12 113.61 -178.308 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 4.1 pm0 -65.48 -43.36 90.48 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.813 0.34 . . . . 6.99 111.889 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -69.23 -35.47 76.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.148 0.499 . . . . 7.48 110.0 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 422' ' ' ALA . . . . . 0.41 ' HB1' ' HB1' ' B' ' 411' ' ' ALA . . . -65.51 -37.51 87.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.47 -0.786 . . . . 3.68 110.397 179.005 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.585 ' HB1' HD11 ' A' ' 8' ' ' LEU . . . -60.2 -43.36 95.98 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.052 0.454 . . . . 3.8 109.991 179.207 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 65.8 m -74.85 -38.59 61.95 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.958 -0.565 . . . . 5.05 111.514 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.5 -46.23 80.51 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.584 -0.28 . . . . 4.36 111.529 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.58 -33.22 72.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.351 -0.386 . . . . 3.21 111.249 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 427' ' ' PHE . . . . . 0.705 ' CE2' ' HB ' ' A' ' 70' ' ' VAL . 0.1 OUTLIER -70.93 -0.94 10.34 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.332 0.493 . . . . 5.27 112.332 -179.882 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -70.29 -6.02 31.98 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.089 0.471 . . . . 5.32 110.996 178.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 30.0 m . . . . . 0 C--O 1.246 0.916 0 CA-C-O 118.692 -0.671 . . . . 5.11 109.871 179.036 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 ptt? . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 110.048 -0.352 . . . . 1.65 110.048 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 75.2 mm-40 -103.84 133.47 48.76 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.616 0.246 . . . . 1.92 110.986 -179.548 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 23.5 pt -129.3 169.34 20.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.31 -0.405 . . . . 1.48 110.04 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.443 ' O ' ' HA ' ' A' ' 66' ' ' THR . 62.4 m-85 -125.45 135.15 52.04 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.423 -0.353 . . . . 2.17 110.23 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.42 HG21 HD12 ' A' ' 15' ' ' LEU . 61.8 t -118.18 120.58 64.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.555 -0.293 . . . . 1.65 110.348 179.574 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.429 ' HE2' HG21 ' A' ' 66' ' ' THR . 38.0 mtmt -96.94 128.6 44.06 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.25 0.547 . . . . 3.16 111.48 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.06 160.07 14.55 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.655 -0.702 . . . . 2.17 110.126 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.645 ' HG ' HG22 ' A' ' 70' ' ' VAL . 0.5 OUTLIER -60.16 -28.16 67.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.78 0.324 . . . . 3.05 111.447 179.97 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.26 29.84 0.22 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.384 -0.371 . . . . 2.7 111.742 -179.597 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 51.66 46.49 53.78 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 121.416 -0.421 . . . . 2.64 112.75 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -126.77 153.67 45.26 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 110.128 -0.323 . . . . 2.34 110.128 -179.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.1 m -128.17 121.42 29.44 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.014 0.435 . . . . 2.31 110.725 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 5.4 mt -106.02 140.06 25.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.03 -0.532 . . . . 1.83 110.544 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.73 135.3 35.17 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.124 -0.324 . . . . 2.02 110.124 179.37 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.585 HD11 HG12 ' A' ' 30' ' ' ILE . 34.9 mt -135.3 137.46 42.48 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.946 0.403 . . . . 1.33 111.522 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -105.66 106.77 17.43 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.691 -0.686 . . . . 2.4 109.229 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 4.2 m -138.98 178.19 4.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.176 -0.466 . . . . 1.25 110.713 -179.058 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -127.13 155.75 75.58 Favored Pre-proline 0 C--N 1.32 -0.682 0 N-CA-C 109.442 -0.577 . . . . 1.85 109.442 179.389 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.605 ' HA ' ' HB2' ' A' ' 56' ' ' LEU . 76.6 Cg_exo -52.34 -29.95 40.93 Favored 'Trans proline' 0 CA--C 1.532 0.378 0 C-N-CA 122.745 2.297 . . . . 1.78 113.017 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.23 -4.37 50.33 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.399 0.518 . . . . 1.8 112.399 -179.524 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.87 135.64 40.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.743 0.306 . . . . 1.23 110.517 -179.73 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.91 145.21 31.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.065 -0.516 . . . . 1.44 110.261 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.527 ' HB ' ' HA ' ' A' ' 52' ' ' ASP . 46.6 mm -55.09 -43.76 71.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 O-C-N 123.111 0.257 . . . . 0.99 111.225 -179.407 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.539 ' HB2' ' HB3' ' A' ' 52' ' ' ASP . 27.6 tt0 -58.63 -38.93 79.13 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.318 -0.401 . . . . 2.22 110.826 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.484 ' O ' ' HG3' ' A' ' 29' ' ' LYS . 64.3 t30 -69.38 -37.34 77.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.244 -0.434 . . . . 1.23 109.939 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.439 ' O ' HG13 ' A' ' 30' ' ' ILE . 97.3 t -62.23 -42.71 96.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.966 -0.561 . . . . 0.64 109.826 179.134 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.3 mtmt -62.81 -34.78 78.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.033 -0.53 . . . . 1.32 110.815 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.56 -38.76 92.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.037 0.446 . . . . 1.08 109.81 178.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.484 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 48.7 mttt -67.57 -32.5 73.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.864 -0.607 . . . . 1.08 110.069 179.278 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.585 HG12 HD11 ' A' ' 15' ' ' LEU . 69.4 mt -69.09 -35.6 69.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.091 -0.504 . . . . 1.31 109.75 179.105 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -65.7 -31.98 73.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.176 -0.465 . . . . 1.93 110.126 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -74.79 -2.5 26.89 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.848 -0.615 . . . . 2.05 110.82 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -121.96 -45.15 2.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.305 -0.407 . . . . 2.17 112.014 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -92.63 -21.84 19.81 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.271 0.471 . . . . 2.14 112.271 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.34 19.39 78.34 Favored Glycine 0 CA--C 1.518 0.256 0 C-N-CA 120.57 -0.824 . . . . 2.01 112.115 -179.375 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.664 HD13 HD21 ' A' ' 71' ' ' LEU . 44.6 mt -104.49 125.73 33.31 Favored Pre-proline 0 C--N 1.327 -0.404 0 N-CA-C 110.337 -0.246 . . . . 1.83 110.337 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.408 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 46.7 Cg_exo -57.8 140.96 95.44 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.835 2.357 . . . . 2.04 112.044 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 37' ' ' PRO . 32.5 Cg_exo -60.11 -18.66 52.44 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 123.126 2.551 . . . . 1.52 112.253 -179.659 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -63.61 -31.71 72.96 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.835 -0.621 . . . . 2.95 110.843 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -102.61 -0.59 31.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.074 -0.512 . . . . 2.56 110.779 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.408 ' HB2' ' HA ' ' A' ' 38' ' ' PRO . 56.3 mt-30 -87.21 120.49 28.55 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.084 -0.507 . . . . 1.4 111.818 -178.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.624 ' HB3' ' HD2' ' B' ' 427' ' ' PHE . 40.8 mtt180 -126.29 124.09 39.55 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.025 -0.731 . . . . 2.65 109.025 178.388 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.571 ' HB3' HD12 ' A' ' 50' ' ' LEU . 85.1 mt -108.92 129.06 55.42 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.898 0.38 . . . . 1.02 111.022 -179.205 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.688 ' HB ' ' CZ ' ' B' ' 427' ' ' PHE . 1.0 OUTLIER -120.67 144.73 28.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 116.062 -0.517 . . . . 2.14 110.366 179.202 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -129.64 101.98 6.15 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.887 -0.783 . . . . 1.71 108.887 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.69 34.31 22.09 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.993 -0.549 . . . . 2.1 110.921 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.74 -9.72 76.85 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 121.038 -0.601 . . . . 1.84 113.358 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -88.72 134.19 33.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.892 0.346 . . . . 3.05 111.522 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -74.82 120.1 19.9 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.512 -0.767 . . . . 2.3 111.232 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.571 HD12 ' HB3' ' A' ' 43' ' ' LEU . 59.1 mt -86.33 110.58 19.76 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.918 -0.401 . . . . 1.17 109.918 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.543 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 33.1 tt0 -74.67 135.74 41.91 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.219 -0.446 . . . . 2.65 111.308 -179.573 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.539 ' HB3' ' HB2' ' A' ' 24' ' ' GLU . 22.2 m-20 -59.93 -31.48 69.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.673 -0.694 . . . . 1.83 111.624 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.543 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -81.93 7.43 62.99 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.924 -0.58 . . . . 1.82 113.4 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 17.7 mmt-85 -115.03 167.74 10.54 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 122.577 -0.366 . . . . 2.69 110.257 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 42.3 p -110.12 176.82 4.91 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.768 0.318 . . . . 1.71 110.615 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.605 ' HB2' ' HA ' ' A' ' 19' ' ' PRO . 80.4 mt -65.62 -36.64 84.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.282 -0.417 . . . . 1.49 111.785 -179.471 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.51 -25.09 66.52 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 111.912 0.338 . . . . 1.94 111.912 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -62.46 -34.8 77.54 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.887 0.375 . . . . 2.03 111.126 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -103.87 15.08 29.49 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.006 -0.543 . . . . 1.76 111.518 -179.265 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 59.45 40.07 21.17 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.436 0.636 . . . . 2.96 111.689 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.459 ' HB ' ' HB3' ' A' ' 56' ' ' LEU . 92.8 mt -83.11 121.66 36.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.929 -0.578 . . . . 1.65 109.883 179.534 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -114.94 -166.23 1.09 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.852 -0.613 . . . . 2.66 110.558 -179.323 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 42.6 pttt -70.09 148.3 48.93 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.493 -0.321 . . . . 3.22 111.515 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 70.96 0.13 3.27 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 113.149 0.796 . . . . 3.12 113.149 179.358 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 16.7 m -65.31 140.8 58.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.837 0.351 . . . . 1.83 110.393 179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.443 ' HA ' ' O ' ' A' ' 4' ' ' PHE . 3.5 m -104.33 126.92 51.85 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.022 0.439 . . . . 2.03 111.501 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.4 mp -108.0 146.35 32.62 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.801 -0.814 . . . . 1.41 108.801 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.655 ' HB2' HG22 ' A' ' 44' ' ' ILE . 44.4 m80 -105.43 134.93 47.74 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.701 0.286 . . . . 2.76 110.845 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 36.4 tp -119.76 115.72 24.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.131 -0.486 . . . . 1.54 111.394 -179.543 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.645 HG22 ' HG ' ' A' ' 8' ' ' LEU . 9.1 t -120.18 129.27 75.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.947 -0.569 . . . . 1.79 109.623 178.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.664 HD21 HD13 ' A' ' 36' ' ' ILE . 58.5 mt -71.5 126.48 29.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.101 -0.499 . . . . 2.43 110.916 -179.635 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.5 92.63 7.65 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.886 -0.597 . . . . 3.19 110.508 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 84.1 mt -77.72 128.77 34.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.276 -0.42 . . . . 2.99 110.799 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.4 mmm180 . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 116.2 -0.455 . . . . 3.67 110.401 179.467 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 390' ' ' PHE . . . . . 0.799 ' HB2' HD11 ' B' ' 395' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.278 0 CA-C-O 120.642 0.258 . . . . 2.51 110.824 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -65.35 146.92 86.94 Favored 'Trans proline' 0 C--O 1.234 0.313 0 C-N-CA 122.924 2.416 . . . . 3.77 112.13 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.23 -56.55 13.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.488 -0.778 . . . . 5.36 112.917 -178.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -61.51 -43.79 98.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.268 -0.424 . . . . 6.89 111.682 -179.148 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 394' ' ' THR . . . . . 0.539 HG23 ' HB2' ' B' ' 419' ' ' ALA . 22.3 m -55.61 -48.6 74.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.976 -0.556 . . . . 4.2 111.439 -179.73 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 395' ' ' ILE . . . . . 0.799 HD11 ' HB2' ' B' ' 390' ' ' PHE . 84.0 mt -61.62 -50.05 81.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.856 0.36 . . . . 3.8 110.266 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -56.6 -45.43 81.42 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.981 0.734 . . . . 6.27 112.981 -178.783 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.58 -33.2 75.36 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.871 -0.331 . . . . 6.91 111.519 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 84.6 mt -78.74 -25.25 44.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.849 0.356 . . . . 4.31 111.268 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 399' ' ' MET . . . . . 0.595 ' HG2' ' O ' ' B' ' 395' ' ' ILE . 31.7 mmt -73.92 -24.87 59.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.072 0.463 . . . . 5.8 109.891 179.252 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -61.27 -30.19 70.31 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.516 -0.765 . . . . 7.71 111.366 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 401' ' ' LEU . . . . . 0.548 ' HB2' ' HD2' ' B' ' 403' ' ' PHE . 9.8 mt -65.4 -15.35 62.5 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.955 -0.566 . . . . 5.69 111.443 -179.776 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 98.0 39.25 3.86 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.735 -0.745 . . . . 5.87 112.082 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 403' ' ' PHE . . . . . 0.548 ' HD2' ' HB2' ' B' ' 401' ' ' LEU . 78.8 m-85 -120.12 154.84 56.02 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-O 120.413 0.149 . . . . 4.83 110.714 -179.725 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -78.79 158.19 27.87 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.526 2.151 . . . . 4.72 112.386 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.594 ' O ' HG12 ' B' ' 408' ' ' VAL . 11.4 ttt85 -63.8 -32.01 73.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.834 -0.621 . . . . 4.16 110.838 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -61.46 -40.3 94.03 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.956 0.408 . . . . 4.69 110.54 179.002 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -65.77 -39.01 90.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.77 -0.65 . . . . 2.99 111.37 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 408' ' ' VAL . . . . . 0.594 HG12 ' O ' ' B' ' 405' ' ' ARG . 1.4 p -66.44 -35.03 73.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 C-N-CA 120.896 -0.322 . . . . 2.06 111.367 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 409' ' ' VAL . . . . . 0.426 HG23 ' O ' ' B' ' 405' ' ' ARG . 84.8 t -67.14 -44.62 87.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.99 0.424 . . . . 2.89 109.892 179.517 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -62.96 -47.06 84.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.812 -0.631 . . . . 5.05 110.587 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -63.94 -45.83 87.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.894 -0.594 . . . . 2.96 110.859 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.94 HD13 ' HA2' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -59.77 -51.44 69.73 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.432 0.531 . . . . 3.45 112.432 -179.262 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 5.9 mtpm? -60.51 -31.47 70.54 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.459 0.541 . . . . 5.52 112.459 -179.153 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -87.86 -18.85 28.32 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 113.362 0.875 . . . . 5.53 113.362 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 35.0 p -107.62 3.99 25.4 Favored 'General case' 0 C--O 1.236 0.36 0 O-C-N 121.858 -0.526 . . . . 5.42 111.77 -178.854 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 67.71 50.83 0.85 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.869 -0.605 . . . . 6.37 111.202 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.94 ' HA2' HD13 ' B' ' 412' ' ' LEU . . . 66.15 -27.33 0.16 Allowed Glycine 0 CA--C 1.528 0.848 0 N-CA-C 117.373 1.709 . . . . 4.33 117.373 176.797 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -58.9 113.98 2.33 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 118.588 1.194 . . . . 6.25 113.199 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 419' ' ' ALA . . . . . 0.539 ' HB2' HG23 ' B' ' 394' ' ' THR . . . -61.02 -26.01 67.3 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.33 -0.85 . . . . 4.12 113.252 -178.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 420' ' ' GLU . . . . . 0.402 ' H ' ' HG2' ' B' ' 420' ' ' GLU . 5.2 mm-40 -59.24 -56.35 23.29 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.585 0.707 . . . . 6.99 110.667 -179.803 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -74.95 -29.79 61.03 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.769 -0.65 . . . . 7.48 110.43 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 422' ' ' ALA . . . . . 0.466 ' HB3' ' HA ' ' B' ' 419' ' ' ALA . . . -60.47 -48.53 81.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.702 -0.681 . . . . 3.68 110.193 179.239 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.518 ' O ' ' HB2' ' B' ' 427' ' ' PHE . . . -62.81 -38.78 92.06 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.873 -0.603 . . . . 3.8 110.006 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 69.0 m -64.28 -31.53 72.77 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.038 -0.528 . . . . 5.05 110.731 178.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 425' ' ' LEU . . . . . 0.619 ' O ' ' HG2' ' B' ' 428' ' ' GLN . 1.1 mm? -81.9 -48.94 10.91 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 112.903 0.705 . . . . 4.36 112.903 -179.316 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.5 pp -64.02 -33.21 75.22 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.768 0.655 . . . . 3.21 112.768 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 427' ' ' PHE . . . . . 0.688 ' CZ ' ' HB ' ' A' ' 44' ' ' ILE . 0.2 OUTLIER -69.3 -1.24 7.64 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 113.893 1.071 . . . . 5.27 113.893 -179.052 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 428' ' ' GLN . . . . . 0.619 ' HG2' ' O ' ' B' ' 425' ' ' LEU . 11.8 pt20 -113.89 23.45 13.0 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.499 0.555 . . . . 5.32 112.499 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 13.3 m . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.584 -0.722 . . . . 5.11 110.302 179.526 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ptt? . . . . . 0 N--CA 1.482 1.152 0 N-CA-C 110.179 -0.304 . . . . 1.65 110.179 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 46.0 mm-40 -107.84 142.62 37.63 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.583 0.23 . . . . 1.92 110.796 -179.498 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 18.1 pt -130.89 153.75 39.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.399 -0.364 . . . . 1.48 110.258 179.249 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -105.16 119.54 39.3 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.544 -0.298 . . . . 2.17 110.597 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.42 ' O ' ' HA ' ' A' ' 12' ' ' THR . 21.3 t -103.16 119.35 51.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 110.027 -0.36 . . . . 1.65 110.027 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -103.12 131.74 49.91 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.266 -0.424 . . . . 3.16 110.983 -179.347 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.71 161.5 13.57 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.139 -0.482 . . . . 2.17 109.877 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.502 HD11 HG13 ' A' ' 70' ' ' VAL . 78.0 mt -59.39 -23.6 62.74 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.258 0.466 . . . . 3.05 112.258 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -79.91 -8.08 59.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.98 0.419 . . . . 2.7 111.699 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.12 3.01 57.97 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.765 -0.731 . . . . 2.64 111.968 -179.547 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -75.44 146.47 40.69 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.457 -0.571 . . . . 2.34 109.457 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.42 ' HA ' ' O ' ' A' ' 5' ' ' VAL . 2.2 m -139.26 119.71 13.92 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.726 0.298 . . . . 2.31 110.897 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 24.4 pt -119.33 148.83 22.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.537 -0.301 . . . . 1.83 110.818 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 6.6 m -103.91 111.64 24.26 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.918 0.389 . . . . 2.02 110.391 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.422 HD21 ' HG3' ' A' ' 33' ' ' LYS . 72.5 mt -104.47 152.39 22.4 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.22 -0.445 . . . . 1.33 111.126 -179.72 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -98.96 121.23 40.65 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.882 -0.599 . . . . 2.4 110.739 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 5.8 m -138.5 163.58 28.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 116.158 -0.474 . . . . 1.25 110.684 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.541 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 20.5 mm-40 -117.94 158.3 46.25 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 116.034 -0.53 . . . . 1.85 109.778 179.378 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -58.29 -23.65 63.75 Favored 'Trans proline' 0 N--CA 1.475 0.405 0 C-N-CA 122.607 2.205 . . . . 1.78 112.388 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -92.71 3.76 55.01 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.171 -0.468 . . . . 1.8 111.599 -179.595 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.541 ' HB2' ' O ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -77.45 130.46 37.05 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 120.833 0.349 . . . . 1.23 110.916 -179.69 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.22 155.23 27.46 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.131 -0.692 . . . . 1.44 109.131 178.627 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.596 ' HB ' ' HA ' ' A' ' 52' ' ' ASP . 43.7 mm -58.59 -38.18 69.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 120.518 0.199 . . . . 0.99 111.347 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -60.62 -34.91 74.95 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.114 0.483 . . . . 2.22 110.3 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.423 ' O ' ' HG3' ' A' ' 29' ' ' LYS . 8.4 m-20 -65.0 -36.14 83.45 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 115.98 -0.555 . . . . 1.23 110.377 179.769 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 22.0 t -66.04 -38.63 82.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.076 -0.511 . . . . 0.64 109.648 179.239 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 23' ' ' ILE . 4.5 mmmm -61.0 -40.9 95.29 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.723 -0.671 . . . . 1.32 109.948 179.369 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.67 -36.08 82.63 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.638 -0.71 . . . . 1.08 110.588 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 87.4 mttt -68.52 -39.93 81.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.423 -0.353 . . . . 1.08 110.47 179.539 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 81.7 mt -66.8 -36.32 76.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 109.41 -0.589 . . . . 1.31 109.41 178.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -66.82 -33.48 75.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.76 -0.654 . . . . 1.93 110.038 179.183 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -69.41 -34.56 74.66 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.699 -0.682 . . . . 2.05 110.821 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.422 ' HG3' HD21 ' A' ' 15' ' ' LEU . 74.3 mmtt -84.88 -61.46 1.77 Allowed 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.581 0.585 . . . . 2.17 112.581 -179.242 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -80.73 -45.94 16.29 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 113.089 0.774 . . . . 2.14 113.089 -177.676 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 99.33 25.44 9.42 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.517 -0.849 . . . . 2.01 111.576 -178.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 71.9 mt -98.62 127.66 35.1 Favored Pre-proline 0 C--N 1.326 -0.451 0 N-CA-C 109.617 -0.512 . . . . 1.83 109.617 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.424 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 77.5 Cg_exo -50.97 133.41 40.42 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.991 2.461 . . . . 2.04 112.104 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 37' ' ' PRO . 32.2 Cg_exo -59.53 -19.68 53.42 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 123.338 2.692 . . . . 1.52 112.625 -179.496 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -21.14 58.52 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.349 -0.387 . . . . 2.95 110.92 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -98.14 -13.9 20.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.139 0.495 . . . . 2.56 110.373 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -78.84 122.83 26.57 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.809 -0.632 . . . . 1.4 111.951 -179.1 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.453 ' HD2' ' OE1' ' A' ' 49' ' ' GLN . 14.1 mmt85 -121.44 107.61 12.67 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.189 -0.671 . . . . 2.65 109.189 177.803 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.807 ' HB3' HD12 ' A' ' 50' ' ' LEU . 69.7 mt -91.87 125.47 36.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.084 -0.507 . . . . 1.02 112.309 -178.846 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.631 ' HB ' ' HB2' ' A' ' 68' ' ' HIS . 43.9 mt -117.23 146.18 22.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.639 -0.709 . . . . 2.14 109.816 179.536 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -132.8 93.16 3.16 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.39 -0.368 . . . . 1.71 110.36 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 56.29 50.46 13.27 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 113.002 0.741 . . . . 2.1 113.002 179.21 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.417 ' HA2' ' HA3' ' B' ' 402' ' ' GLY . . . 96.63 -38.69 3.01 Favored Glycine 0 CA--C 1.517 0.172 0 C-N-CA 120.721 -0.752 . . . . 1.84 113.525 179.193 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -85.8 153.27 22.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.67 0.235 . . . . 3.05 110.513 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.453 ' OE1' ' HD2' ' A' ' 42' ' ' ARG . 9.9 tt0 -97.77 145.57 26.24 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.998 0.428 . . . . 2.3 111.031 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.807 HD12 ' HB3' ' A' ' 43' ' ' LEU . 73.0 mt -89.71 122.97 33.32 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.652 -0.703 . . . . 1.17 110.441 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.581 ' HB3' ' HG2' ' A' ' 54' ' ' ARG . 0.1 OUTLIER -88.83 130.14 35.44 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.094 -0.503 . . . . 2.65 110.225 -179.721 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.596 ' HA ' ' HB ' ' A' ' 23' ' ' ILE . 35.7 m-20 -54.69 -28.31 46.75 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.045 0.387 . . . . 1.83 112.045 -179.438 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -85.38 10.86 62.65 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.918 -0.658 . . . . 1.82 113.231 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.581 ' HG2' ' HB3' ' A' ' 51' ' ' GLU . 81.6 mmt-85 -115.75 169.92 8.84 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 117.011 0.405 . . . . 2.69 110.866 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 25.9 p -111.61 166.16 11.39 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.773 -0.649 . . . . 1.71 109.638 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.456 HD12 ' O ' ' A' ' 18' ' ' GLU . 83.7 mt -64.16 -28.45 69.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.067 0.461 . . . . 1.49 110.942 179.502 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.8 m -73.08 -19.59 61.13 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.866 -0.606 . . . . 1.94 111.698 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -66.7 -34.22 77.36 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.103 0.478 . . . . 2.03 110.65 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.41 ' HB2' HG13 ' A' ' 61' ' ' ILE . 60.3 m-85 -101.69 8.95 41.41 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.807 -0.633 . . . . 1.76 109.934 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 53.37 49.71 19.12 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.653 -0.703 . . . . 2.96 110.512 -179.113 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.41 HG13 ' HB2' ' A' ' 59' ' ' TYR . 79.8 mt -81.67 106.88 13.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.47 -0.786 . . . . 1.65 110.003 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -84.76 177.98 7.81 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.718 -0.674 . . . . 2.66 110.399 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.87 148.66 51.64 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.199 -0.455 . . . . 3.22 110.173 179.234 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 74.17 8.69 4.63 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 113.065 0.765 . . . . 3.12 113.065 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.6 m -70.94 150.35 45.8 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 122.13 -0.357 . . . . 1.83 110.958 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.6 m -104.14 127.71 51.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.047 0.451 . . . . 2.03 111.109 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.8 mp -111.08 145.75 38.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.669 -0.696 . . . . 1.41 109.314 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.631 ' HB2' ' HB ' ' A' ' 44' ' ' ILE . 65.3 m80 -102.74 129.7 49.45 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.749 0.309 . . . . 2.76 111.631 -179.502 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 51.6 tp -110.12 105.68 14.86 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.945 -0.571 . . . . 1.54 110.483 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.502 HG13 HD11 ' A' ' 8' ' ' LEU . 62.6 t -98.01 137.0 26.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 115.884 -0.598 . . . . 1.79 110.424 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 66.9 mt -86.62 107.95 18.4 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.047 -0.524 . . . . 2.43 109.625 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.479 HH21 ' HA ' ' B' ' 428' ' ' GLN . 0.4 OUTLIER -104.13 95.3 5.88 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.241 -0.436 . . . . 3.19 111.037 -179.404 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 42.7 mt -80.56 161.7 24.65 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.045 -0.525 . . . . 2.99 109.625 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.1 mmt180 . . . . . 0 C--N 1.324 -0.509 0 CA-C-O 120.856 0.36 . . . . 3.67 110.994 -179.794 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 390' ' ' PHE . . . . . 0.587 ' HD1' HD11 ' B' ' 395' ' ' ILE . 0.5 OUTLIER . . . . . 0 N--CA 1.455 -0.205 0 CA-C-O 120.67 0.272 . . . . 2.51 110.721 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 391' ' ' PRO . . . . . 0.454 ' O ' HG13 ' B' ' 395' ' ' ILE . 32.0 Cg_exo -60.16 149.98 81.98 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 122.87 2.38 . . . . 3.77 112.421 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -53.51 -46.45 70.09 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.651 -0.704 . . . . 5.36 112.719 -179.046 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 393' ' ' GLN . . . . . 0.511 ' O ' ' HG2' ' B' ' 397' ' ' GLN . 41.6 tt0 -54.88 -51.29 66.43 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.828 0.347 . . . . 6.89 111.499 -179.482 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -39.72 86.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.948 -0.569 . . . . 4.2 111.736 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 395' ' ' ILE . . . . . 0.587 HD11 ' HD1' ' B' ' 390' ' ' PHE . 73.3 mt -61.71 -51.36 73.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-O 120.884 0.373 . . . . 3.8 109.996 179.63 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -55.12 -33.68 63.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.788 -0.642 . . . . 6.27 112.57 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 397' ' ' GLN . . . . . 0.511 ' HG2' ' O ' ' B' ' 393' ' ' GLN . 19.9 mm-40 -69.32 -53.57 18.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.941 0.4 . . . . 6.91 110.822 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 88.8 mt -67.57 -29.45 68.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.023 -0.535 . . . . 4.31 112.3 -178.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 28.6 mmt -68.96 -27.57 65.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.62 0.248 . . . . 5.8 111.45 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -71.45 -19.57 62.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.044 -0.525 . . . . 7.71 111.537 -179.151 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 47.5 mt -69.62 -26.53 64.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.231 -0.441 . . . . 5.69 110.966 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 402' ' ' GLY . . . . . 0.417 ' HA3' ' HA2' ' A' ' 47' ' ' GLY . . . 112.83 6.75 22.67 Favored Glycine 0 N--CA 1.453 -0.172 0 C-N-CA 120.685 -0.769 . . . . 5.87 112.567 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -89.64 150.14 43.62 Favored Pre-proline 0 C--N 1.328 -0.354 0 N-CA-C 110.393 -0.225 . . . . 4.83 110.393 179.753 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -72.65 156.47 53.52 Favored 'Trans proline' 0 C--O 1.236 0.393 0 C-N-CA 122.457 2.105 . . . . 4.72 111.347 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.422 HH11 ' HD3' ' B' ' 405' ' ' ARG . 36.3 ttt-85 -60.65 -30.7 70.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.51 -0.314 . . . . 4.16 111.498 -179.439 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -58.89 -38.69 79.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.332 -0.395 . . . . 4.69 110.844 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -62.37 -38.56 90.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.968 -0.56 . . . . 2.99 110.041 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 408' ' ' VAL . . . . . 0.672 HG13 HD23 ' B' ' 412' ' ' LEU . 2.6 t -65.33 -43.53 94.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.898 -0.592 . . . . 2.06 110.647 179.59 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 409' ' ' VAL . . . . . 0.412 ' O ' ' HB2' ' B' ' 413' ' ' LYS . 48.7 t -57.06 -49.03 80.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.248 -0.433 . . . . 2.89 110.45 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 75.6 mttt -68.08 -48.0 66.72 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.94 -0.573 . . . . 5.05 111.717 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -60.75 -50.71 72.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.321 0.489 . . . . 2.96 112.321 -179.171 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.672 HD23 HG13 ' B' ' 408' ' ' VAL . 3.8 mm? -65.17 -30.83 71.78 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.466 0.543 . . . . 3.45 112.466 -178.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 413' ' ' LYS . . . . . 0.412 ' HB2' ' O ' ' B' ' 409' ' ' VAL . 6.8 mmtt -68.84 -37.97 79.5 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 111.83 0.308 . . . . 5.52 111.83 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -87.68 -8.13 56.52 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 113.018 0.748 . . . . 5.53 113.018 -179.343 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 415' ' ' THR . . . . . 0.532 HG21 ' HA ' ' B' ' 422' ' ' ALA . 25.1 p -109.22 -19.39 13.34 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 120.934 0.397 . . . . 5.42 111.574 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 68.3 62.1 0.38 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.19 0.811 . . . . 6.37 113.19 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 79.44 -23.34 3.47 Favored Glycine 0 CA--C 1.521 0.465 0 N-CA-C 115.547 0.979 . . . . 4.33 115.547 177.607 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -65.94 103.33 0.91 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 117.585 0.692 . . . . 6.25 110.546 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -67.13 -38.72 86.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.914 -0.585 . . . . 4.12 111.614 -179.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -66.24 -38.74 88.6 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-O 121.299 0.571 . . . . 6.99 110.018 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -72.92 -36.01 67.17 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.876 -0.787 . . . . 7.48 108.876 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 422' ' ' ALA . . . . . 0.532 ' HA ' HG21 ' B' ' 415' ' ' THR . . . -62.69 -43.25 99.29 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.734 -0.666 . . . . 3.68 110.161 178.822 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.481 ' HB1' ' CG1' ' A' ' 70' ' ' VAL . . . -61.16 -38.18 85.54 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.215 0.531 . . . . 3.8 110.151 179.282 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 17.7 m -72.35 -34.85 68.31 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.53 -0.759 . . . . 5.05 110.45 178.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -71.53 -46.12 60.48 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.993 -0.548 . . . . 4.36 111.715 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.7 pp -65.41 -34.08 77.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.107 0.479 . . . . 3.21 111.136 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 427' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -77.16 2.88 14.03 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 113.405 0.891 . . . . 5.27 113.405 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 428' ' ' GLN . . . . . 0.479 ' HA ' HH21 ' A' ' 72' ' ' ARG . 2.5 pt20 -57.66 -23.42 51.24 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 120.799 0.333 . . . . 5.32 110.76 178.744 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.667 -0.682 . . . . 5.11 110.276 179.699 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.455 ' HB2' ' HB3' ' A' ' 63' ' ' LYS . 26.1 ptt? . . . . . 0 N--CA 1.483 1.209 0 CA-C-O 120.569 0.223 . . . . 1.65 110.694 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 71.0 mm-40 -112.48 145.31 40.44 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.901 0.381 . . . . 1.92 111.953 -179.095 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 20.2 pt -130.12 155.04 41.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.993 -0.549 . . . . 1.48 109.54 178.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -111.14 115.14 28.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.736 0.303 . . . . 2.17 110.899 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.6 t -99.97 119.79 48.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.389 -0.368 . . . . 1.65 110.615 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.7 ' HE3' HG21 ' A' ' 66' ' ' THR . 89.5 mttt -94.57 128.98 41.56 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.299 -0.41 . . . . 3.16 110.566 179.618 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.22 163.65 12.31 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.206 -0.452 . . . . 2.17 110.088 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 27.9 mt -62.85 -20.8 65.44 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.937 0.399 . . . . 3.05 111.72 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.3 p -81.84 -3.76 54.83 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.245 -0.434 . . . . 2.7 110.846 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.78 -6.87 77.19 Favored Glycine 0 C--N 1.335 0.492 0 N-CA-C 111.369 -0.692 . . . . 2.64 111.369 -179.091 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -68.32 149.67 49.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.35 -0.425 . . . . 2.34 110.811 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.3 m -126.19 128.37 47.14 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.366 -0.605 . . . . 2.31 109.366 178.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.2 mt -113.35 129.45 69.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.651 -0.25 . . . . 1.83 111.461 -178.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.96 110.03 22.31 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.995 -0.743 . . . . 2.02 108.995 178.634 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.7 mt -114.77 142.05 47.05 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.513 0.56 . . . . 1.33 112.513 -178.498 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -84.44 120.24 26.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.423 -0.808 . . . . 2.4 109.401 179.068 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 15.3 m -142.34 178.8 2.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 116.146 -0.479 . . . . 1.25 109.998 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -145.71 163.26 32.3 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 109.019 -0.734 . . . . 1.85 109.019 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -55.82 -27.04 60.41 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.418 2.078 . . . . 1.78 112.758 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.07 11.44 18.44 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.301 -0.409 . . . . 1.8 111.78 -179.6 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -86.66 134.17 33.63 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.031 -0.359 . . . . 1.23 110.031 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.41 ' O ' HG23 ' A' ' 26' ' ' VAL . 0.7 OUTLIER -92.36 148.69 21.92 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.38 -0.373 . . . . 1.44 110.698 -179.96 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.607 ' HB ' ' HA ' ' A' ' 52' ' ' ASP . 44.8 mm -55.36 -41.1 60.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.376 -0.374 . . . . 0.99 111.792 -179.59 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -65.17 -30.04 70.92 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.881 0.372 . . . . 2.22 111.266 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -76.2 -37.21 58.09 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.586 -0.524 . . . . 1.23 109.586 179.474 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 22' ' ' THR . 66.8 t -64.76 -37.13 79.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.854 -0.612 . . . . 0.64 109.922 178.905 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -60.52 -37.1 80.07 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.79 -0.641 . . . . 1.32 111.074 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.29 -36.66 84.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 1.08 110.282 179.373 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 87.0 mttt -65.72 -38.23 88.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.835 -0.62 . . . . 1.08 110.265 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 47.3 mt -70.32 -30.95 45.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.176 -0.465 . . . . 1.31 110.312 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -71.09 -34.54 71.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.96 0.409 . . . . 1.93 110.205 179.181 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -72.59 -33.68 66.9 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.145 0.497 . . . . 2.05 110.681 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -83.62 -63.11 1.41 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.026 -0.534 . . . . 2.17 112.43 -179.584 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -79.7 -48.61 13.39 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.479 0.548 . . . . 2.14 112.479 -178.398 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 115.8 -12.2 17.94 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.707 -0.759 . . . . 2.01 111.727 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.424 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 13.0 mt -68.57 124.29 89.67 Favored Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 110.338 -0.245 . . . . 1.83 110.338 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.443 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 33.6 Cg_exo -63.12 143.62 90.65 Favored 'Trans proline' 0 C--O 1.233 0.274 0 C-N-CA 122.84 2.36 . . . . 2.04 111.457 179.275 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 37' ' ' PRO . 50.0 Cg_exo -56.7 -23.64 50.57 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.332 2.688 . . . . 1.52 112.297 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.96 -23.41 65.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.97 -0.559 . . . . 2.95 110.612 179.55 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.403 ' HA ' ' HB3' ' A' ' 72' ' ' ARG . 32.9 mt-30 -112.06 9.37 20.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.955 -0.566 . . . . 2.56 110.543 -179.347 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -97.0 100.16 11.68 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.767 -0.651 . . . . 1.4 111.244 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 52.4 mtp180 -104.46 103.89 13.66 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.05 -0.722 . . . . 2.65 109.05 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.3 mp -104.51 144.1 32.14 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.885 0.698 . . . . 1.02 112.885 -178.424 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.596 HG13 ' HB2' ' A' ' 68' ' ' HIS . 1.0 OUTLIER -135.44 151.37 30.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.36 -0.836 . . . . 2.14 110.268 179.048 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.481 ' HB2' HD21 ' A' ' 50' ' ' LEU . 61.6 t80 -121.02 87.74 2.81 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.104 -0.702 . . . . 1.71 109.104 178.643 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 56.1 65.86 1.34 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.826 -0.625 . . . . 2.1 111.946 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 76.13 -9.28 19.86 Favored Glycine 0 CA--C 1.521 0.467 0 CA-C-N 115.801 -0.636 . . . . 1.84 114.301 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.424 ' HE2' ' O ' ' A' ' 45' ' ' PHE . 27.3 mtmm -100.88 124.61 46.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 117.25 0.525 . . . . 3.05 111.192 -179.508 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -75.43 134.55 40.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.25 -0.432 . . . . 2.3 110.489 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.481 HD21 ' HB2' ' A' ' 45' ' ' PHE . 36.8 mt -93.07 125.56 37.72 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.295 -0.411 . . . . 1.17 111.24 -179.268 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.428 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 32.3 tt0 -89.11 132.16 34.93 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.81 -0.441 . . . . 2.65 109.81 179.199 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.607 ' HA ' ' HB ' ' A' ' 23' ' ' ILE . 24.0 m-20 -56.19 -30.66 62.57 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.974 0.731 . . . . 1.83 112.974 -178.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.428 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -87.72 18.23 40.22 Favored Glycine 0 CA--C 1.519 0.286 0 C-N-CA 120.948 -0.644 . . . . 1.82 113.356 -179.402 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 22.4 mmm-85 -120.28 163.61 17.55 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.966 0.383 . . . . 2.69 111.099 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.472 ' O ' ' HB2' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -103.42 169.19 8.68 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.674 -0.694 . . . . 1.71 110.211 179.753 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.444 ' HB3' ' HB ' ' A' ' 61' ' ' ILE . 72.8 mt -63.33 -33.84 76.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.824 0.345 . . . . 1.49 111.527 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.08 -19.1 65.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.188 -0.46 . . . . 1.94 111.329 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.472 ' HB2' ' O ' ' A' ' 55' ' ' THR . 1.5 m-20 -65.38 -31.15 72.11 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 116.233 -0.439 . . . . 2.03 111.548 -179.669 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.444 ' HB2' HG13 ' A' ' 61' ' ' ILE . 47.1 m-85 -111.91 14.23 20.91 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.287 -0.415 . . . . 1.76 110.407 -179.399 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 48.8 t30 59.67 34.14 22.08 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.455 -0.793 . . . . 2.96 111.289 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.444 ' HB ' ' HB3' ' A' ' 56' ' ' LEU . 72.7 mt -75.66 109.8 9.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.848 -0.615 . . . . 1.65 109.725 179.426 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -106.14 -166.6 1.21 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.871 -0.604 . . . . 2.66 110.685 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.455 ' HB3' ' HB2' ' A' ' 1' ' ' MET . 8.3 pttm -68.95 145.26 53.78 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.409 -0.359 . . . . 3.22 110.993 179.499 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 71.74 8.34 6.09 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.495 0.924 . . . . 3.12 113.495 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.436 ' HB3' ' HE1' ' A' ' 45' ' ' PHE . 28.1 m -72.03 143.31 49.19 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.754 0.312 . . . . 1.83 110.262 179.22 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.7 HG21 ' HE3' ' A' ' 6' ' ' LYS . 0.2 OUTLIER -100.43 125.7 46.75 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.192 -0.458 . . . . 2.03 111.21 -179.666 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.0 mp -114.54 146.14 41.1 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.491 -0.929 . . . . 1.41 108.491 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.596 ' HB2' HG13 ' A' ' 44' ' ' ILE . 63.8 m80 -109.63 137.63 47.17 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 120.726 0.298 . . . . 2.76 111.56 -179.046 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 52.0 tp -118.35 116.48 26.83 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.934 -0.575 . . . . 1.54 111.128 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 22.9 t -98.71 129.28 49.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.691 -0.686 . . . . 1.79 109.648 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 58.3 mt -76.06 117.74 18.09 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.769 -0.65 . . . . 2.43 111.106 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.403 ' HB3' ' HA ' ' A' ' 40' ' ' GLN . 60.3 ttt180 -93.27 103.15 15.42 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.832 -0.622 . . . . 3.19 110.815 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 34.9 mt -78.8 120.88 24.07 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.099 -0.501 . . . . 2.99 110.71 179.432 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 . . . . . 0 C--N 1.325 -0.471 0 CA-C-N 116.255 -0.429 . . . . 3.67 110.669 179.77 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 390' ' ' PHE . . . . . 0.406 ' HA ' ' HD3' ' B' ' 391' ' ' PRO . 26.0 m-85 . . . . . 0 N--CA 1.452 -0.358 0 CA-C-O 120.6 0.238 . . . . 2.51 110.439 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 391' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' B' ' 390' ' ' PHE . 15.3 Cg_exo -70.04 130.87 19.71 Favored 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.792 2.328 . . . . 3.77 111.359 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -50.67 -49.22 57.72 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.886 0.699 . . . . 5.36 112.886 -179.205 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -60.22 -42.15 94.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.437 -0.347 . . . . 6.89 111.086 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 11.2 m -63.74 -43.4 96.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.037 -0.528 . . . . 4.2 110.969 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 395' ' ' ILE . . . . . . . . . . . . . 84.8 mt -59.14 -49.27 83.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.493 -0.321 . . . . 3.8 110.685 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -61.51 -42.95 99.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.007 -0.542 . . . . 6.27 111.281 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -64.6 -44.67 89.87 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.777 0.322 . . . . 6.91 111.217 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 98.1 mt -66.59 -37.97 86.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 4.31 111.717 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 399' ' ' MET . . . . . 0.401 ' HA ' ' O ' ' B' ' 403' ' ' PHE . 39.0 mtp -67.51 -32.79 73.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.459 -0.337 . . . . 5.8 111.397 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -65.66 -28.55 69.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.267 -0.424 . . . . 7.71 111.215 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 401' ' ' LEU . . . . . 0.432 HD22 ' HB3' ' A' ' 68' ' ' HIS . 14.3 mt -64.97 -18.46 65.29 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.131 0.491 . . . . 5.69 110.681 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 107.91 23.28 6.85 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.76 -0.655 . . . . 5.87 111.524 -179.356 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 403' ' ' PHE . . . . . 0.401 ' O ' ' HA ' ' B' ' 399' ' ' MET . 39.9 m-85 -114.38 139.44 23.88 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-O 120.768 0.318 . . . . 4.83 110.806 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -77.16 164.39 29.39 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.671 2.248 . . . . 4.72 112.056 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 56.3 mtt180 -60.11 -28.06 67.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.835 -0.62 . . . . 4.16 110.798 179.723 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -58.07 -44.65 87.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.712 -0.676 . . . . 4.69 110.675 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -67.66 -36.3 80.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.635 -0.711 . . . . 2.99 110.117 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 91.0 t -60.96 -53.27 51.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.659 -0.7 . . . . 2.06 110.521 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 88.1 t -54.8 -49.51 68.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.136 -0.484 . . . . 2.89 112.046 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -66.23 -49.51 66.98 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.747 0.647 . . . . 5.05 112.747 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -64.16 -48.5 75.76 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.374 0.509 . . . . 2.96 112.374 -178.509 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -62.72 -39.82 95.24 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.463 0.542 . . . . 3.45 112.463 -178.679 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 13.4 mmmt -64.26 -42.29 96.53 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.147 0.425 . . . . 5.52 112.147 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -77.87 -8.91 58.71 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.478 0.547 . . . . 5.53 112.478 -179.21 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 25.3 p -113.3 8.23 17.99 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.754 0.311 . . . . 5.42 111.63 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 61.33 39.78 15.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.071 -0.513 . . . . 6.37 112.362 179.198 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 79.7 -15.68 13.56 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.715 -0.755 . . . . 4.33 114.194 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 418' ' ' ASN . . . . . 0.78 HD21 ' HB2' ' B' ' 421' ' ' PHE . 0.1 OUTLIER -67.9 106.06 2.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 117.973 0.886 . . . . 6.25 110.99 -179.916 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 419' ' ' ALA . . . . . 0.453 ' HA ' ' HB3' ' B' ' 422' ' ' ALA . . . -62.59 -25.8 68.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.969 -1.014 . . . . 4.12 112.903 -178.241 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -60.18 -56.4 22.09 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.2 0.524 . . . . 6.99 110.69 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 421' ' ' PHE . . . . . 0.78 ' HB2' HD21 ' B' ' 418' ' ' ASN . 23.4 m-85 -73.86 -29.27 62.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.081 -0.509 . . . . 7.48 110.415 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 422' ' ' ALA . . . . . 0.453 ' HB3' ' HA ' ' B' ' 419' ' ' ALA . . . -61.4 -46.56 89.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.297 -0.41 . . . . 3.68 110.557 179.291 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -64.78 -38.52 91.28 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.982 -0.554 . . . . 3.8 110.381 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 1.3 t -70.1 -26.15 63.84 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.13 -0.486 . . . . 5.05 110.503 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 425' ' ' LEU . . . . . 0.474 ' O ' ' HG2' ' B' ' 428' ' ' GLN . 0.5 OUTLIER -79.56 -49.77 11.72 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 116.095 -0.502 . . . . 4.36 111.401 179.961 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.2 pp -61.46 -33.19 73.34 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.132 0.419 . . . . 3.21 112.132 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 427' ' ' PHE . . . . . 0.595 ' CZ ' HG23 ' A' ' 44' ' ' ILE . 1.4 t80 -61.84 -12.51 17.84 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.871 0.693 . . . . 5.27 112.871 -179.582 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 428' ' ' GLN . . . . . 0.474 ' HG2' ' O ' ' B' ' 425' ' ' LEU . 23.7 pt20 -67.7 -7.53 27.81 Favored 'General case' 0 C--O 1.235 0.314 0 O-C-N 122.216 -0.302 . . . . 5.32 111.51 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.654 -0.689 . . . . 5.11 110.511 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.523 ' HG2' ' O ' ' A' ' 17' ' ' VAL . 23.0 ptt? . . . . . 0 N--CA 1.476 0.859 0 CA-C-O 120.867 0.365 . . . . 1.65 110.492 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' GLN . . . . . 0.498 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 65.3 mm-40 -87.01 142.4 27.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.935 0.398 . . . . 1.92 111.296 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 27.6 pt -127.58 162.51 32.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.862 -0.608 . . . . 1.48 109.874 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 68.5 m-85 -112.35 117.03 31.34 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.57 -0.287 . . . . 2.17 110.442 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.41 HG21 HD12 ' A' ' 15' ' ' LEU . 36.1 t -106.04 124.65 61.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.439 -0.346 . . . . 1.65 110.375 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -100.37 155.72 17.65 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.213 -0.449 . . . . 3.16 110.762 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.0 p -128.25 169.16 14.51 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.722 -0.844 . . . . 2.17 108.722 178.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 96.2 mt -71.29 -4.38 25.63 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.997 0.369 . . . . 3.05 111.997 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.92 11.75 38.07 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.002 0.43 . . . . 2.7 110.911 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.85 18.47 74.3 Favored Glycine 0 N--CA 1.451 -0.362 0 CA-C-N 115.935 -0.575 . . . . 2.64 112.786 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -95.15 127.0 40.86 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.643 0.259 . . . . 2.34 110.402 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.7 m -107.79 126.34 52.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.345 -0.389 . . . . 2.31 110.11 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.7 mt -116.48 144.76 23.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 116.289 -0.414 . . . . 1.83 110.432 -179.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.33 143.08 30.94 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.94 -0.393 . . . . 2.02 109.94 179.251 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.538 HD11 HG12 ' A' ' 30' ' ' ILE . 59.5 mt -138.96 143.12 38.43 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.702 0.287 . . . . 1.33 111.594 -179.632 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -97.32 108.79 21.59 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.987 -0.746 . . . . 2.4 108.987 178.567 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.523 ' O ' ' HG2' ' A' ' 1' ' ' MET . 4.6 m -135.34 168.58 22.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 116.471 -0.331 . . . . 1.25 110.749 -179.357 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.415 ' O ' HD12 ' A' ' 56' ' ' LEU . 61.1 mm-40 -127.69 159.46 65.99 Favored Pre-proline 0 C--N 1.319 -0.725 0 N-CA-C 109.316 -0.624 . . . . 1.85 109.316 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -52.55 -35.98 69.1 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.79 2.326 . . . . 1.78 112.806 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.56 3.36 22.04 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.74 0.644 . . . . 1.8 112.74 -179.06 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -79.88 138.22 37.11 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.907 -0.317 . . . . 1.23 111.146 -179.475 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.1 OUTLIER -86.74 147.91 25.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.049 -0.523 . . . . 1.44 110.488 -179.901 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 48.5 mm -56.78 -36.48 49.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-O 120.872 0.367 . . . . 0.99 110.655 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -58.26 -43.44 87.88 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.9 -0.591 . . . . 2.22 109.915 178.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -70.07 -35.83 74.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.74 -0.663 . . . . 1.23 110.323 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 22' ' ' THR . 98.2 t -62.54 -44.41 99.31 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 N-CA-C 109.646 -0.501 . . . . 0.64 109.646 179.123 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -63.21 -34.67 78.15 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.176 -0.466 . . . . 1.32 110.16 179.109 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.86 -34.79 78.95 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.054 -0.521 . . . . 1.08 109.627 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -68.76 -34.99 76.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.779 -0.646 . . . . 1.08 109.857 178.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.538 HG12 HD11 ' A' ' 15' ' ' LEU . 57.5 mt -72.56 -40.85 63.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 108.86 -0.793 . . . . 1.31 108.86 178.37 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -60.57 -37.05 80.04 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.599 -0.728 . . . . 1.93 110.626 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -65.13 -30.54 71.47 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.07 -0.514 . . . . 2.05 111.751 -179.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -93.12 -49.25 6.09 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 113.074 0.768 . . . . 2.17 113.074 -178.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 51.5 mm-40 -88.45 -19.34 26.64 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 113.4 0.889 . . . . 2.14 113.4 -177.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.28 24.37 77.04 Favored Glycine 0 N--CA 1.453 -0.202 0 C-N-CA 120.717 -0.754 . . . . 2.01 112.57 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 77.1 mt -99.03 129.82 28.77 Favored Pre-proline 0 C--N 1.327 -0.384 0 O-C-N 122.869 -0.195 . . . . 1.83 110.642 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -52.1 136.39 53.41 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 123.028 2.485 . . . . 2.04 112.493 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -64.84 -15.22 49.2 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.971 2.448 . . . . 1.52 112.902 -179.086 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -78.76 -26.91 44.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.996 0.427 . . . . 2.95 110.607 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -94.77 -11.15 29.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.215 0.531 . . . . 2.56 110.084 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -78.98 109.9 13.71 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.464 -0.789 . . . . 1.4 111.72 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.566 ' HB3' ' CE2' ' B' ' 427' ' ' PHE . 7.9 mmt180 -111.35 102.16 10.57 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.436 -0.579 . . . . 2.65 109.436 178.485 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.616 ' HB3' HD12 ' A' ' 50' ' ' LEU . 18.0 mt -88.64 135.21 33.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.157 -0.474 . . . . 1.02 111.759 -179.058 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.758 HD12 ' HB3' ' B' ' 401' ' ' LEU . 0.0 OUTLIER -129.89 150.16 34.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.846 -0.615 . . . . 2.14 110.673 179.571 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.554 ' HB2' HD21 ' A' ' 50' ' ' LEU . 29.6 t80 -133.48 96.04 3.63 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.654 -0.703 . . . . 1.71 109.144 178.446 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.68 39.81 20.65 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.795 -0.638 . . . . 2.1 111.867 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.23 -16.56 61.05 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.734 -0.746 . . . . 1.84 113.153 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 42.4 mtmt -93.11 114.57 27.13 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 122.821 -0.223 . . . . 3.05 111.157 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -68.35 136.36 53.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.269 -0.423 . . . . 2.3 110.365 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.616 HD12 ' HB3' ' A' ' 43' ' ' LEU . 18.6 mt -92.59 122.74 35.31 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.261 -0.427 . . . . 1.17 111.883 -178.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.7 ' HB2' ' HG2' ' A' ' 54' ' ' ARG . 30.3 mt-10 -80.13 150.02 30.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.1 -0.5 . . . . 2.65 110.475 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -65.54 -33.43 75.9 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.791 -0.64 . . . . 1.83 111.992 -178.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -85.2 17.09 34.89 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.995 -0.622 . . . . 1.82 114.353 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.7 ' HG2' ' HB2' ' A' ' 51' ' ' GLU . 20.3 mmt180 -117.11 165.24 13.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 117.285 0.542 . . . . 2.69 110.868 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 22' ' ' THR . 19.5 p -109.49 177.78 4.64 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.044 -0.525 . . . . 1.71 109.589 178.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.415 HD12 ' O ' ' A' ' 18' ' ' GLU . 75.9 mt -67.22 -36.68 82.2 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.836 0.35 . . . . 1.49 111.111 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.2 m -67.22 -21.76 65.74 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.326 -0.397 . . . . 1.94 111.561 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -67.67 -28.34 67.61 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.544 -0.298 . . . . 2.03 111.247 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -112.58 14.3 20.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.824 0.345 . . . . 1.76 111.058 -179.642 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 59.32 38.13 23.22 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.723 -0.672 . . . . 2.96 111.455 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 73.7 mt -84.39 107.76 15.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.015 -0.539 . . . . 1.65 109.848 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -101.46 -167.06 1.37 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.87 -0.605 . . . . 2.66 110.58 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.507 ' HB3' ' HB2' ' A' ' 1' ' ' MET . 56.3 pttt -72.4 144.5 48.16 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.693 0.282 . . . . 3.22 111.261 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 68.84 18.87 8.5 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.61 -0.723 . . . . 3.12 112.939 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 51.5 m -76.58 154.74 34.18 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.74 -0.467 . . . . 1.83 109.74 178.819 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.4 m -105.76 119.55 39.44 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.934 0.397 . . . . 2.03 111.099 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.4 mp -111.34 148.98 31.81 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.671 -0.695 . . . . 1.41 109.193 179.432 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -116.1 137.56 52.02 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 120.721 0.296 . . . . 2.76 111.188 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 33.4 tp -116.16 115.01 25.25 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.158 -0.474 . . . . 1.54 111.329 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.533 HG23 HD11 ' A' ' 44' ' ' ILE . 39.7 t -105.24 132.58 51.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.995 -0.548 . . . . 1.79 110.091 179.265 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 78.3 mt -91.26 109.55 20.82 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.448 -0.575 . . . . 2.43 109.448 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.545 ' HG3' ' HA ' ' B' ' 424' ' ' SER . 23.3 ttt180 -92.06 117.69 30.08 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.142 0.496 . . . . 3.19 111.159 -179.702 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.8 mt -89.01 155.89 19.2 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.689 -0.687 . . . . 2.99 110.3 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 74' ' ' ARG . 14.1 mmt180 . . . . . 0 C--N 1.326 -0.444 0 CA-C-O 121.27 0.557 . . . . 3.67 109.979 179.063 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 390' ' ' PHE . . . . . 0.719 ' HB2' HD11 ' B' ' 395' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.24 0 N-CA-C 110.481 -0.192 . . . . 2.51 110.481 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -64.83 147.63 89.59 Favored 'Trans proline' 0 C--O 1.235 0.361 0 C-N-CA 122.645 2.23 . . . . 3.77 111.349 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -49.86 -59.23 4.04 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 113.588 0.959 . . . . 5.36 113.588 -178.374 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -48.91 -52.41 24.7 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.554 0.575 . . . . 6.89 112.554 -179.031 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 394' ' ' THR . . . . . 0.431 HG22 ' HB2' ' B' ' 419' ' ' ALA . 0.0 OUTLIER -56.09 -43.11 77.74 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.348 -0.387 . . . . 4.2 111.759 -179.467 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 395' ' ' ILE . . . . . 0.719 HD11 ' HB2' ' B' ' 390' ' ' PHE . 75.0 mt -66.16 -51.82 55.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.412 -0.358 . . . . 3.8 110.399 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -57.78 -40.38 79.7 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.961 -0.563 . . . . 6.27 112.099 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 397' ' ' GLN . . . . . 0.438 ' O ' ' HG ' ' B' ' 401' ' ' LEU . 28.1 mm-40 -63.72 -43.52 96.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.932 0.396 . . . . 6.91 110.703 179.244 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 398' ' ' LEU . . . . . 0.518 HD13 HG23 ' B' ' 408' ' ' VAL . 1.0 OUTLIER -73.98 -33.9 64.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.95 -0.568 . . . . 4.31 111.801 -179.462 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 399' ' ' MET . . . . . 0.47 ' HE1' ' HB ' ' B' ' 408' ' ' VAL . 30.3 mmt -67.12 -40.94 86.9 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.821 0.343 . . . . 5.8 111.269 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -63.76 -24.52 67.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 7.71 112.119 -178.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 401' ' ' LEU . . . . . 0.758 ' HB3' HD12 ' A' ' 44' ' ' ILE . 31.9 mt -63.29 -23.28 67.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.026 0.441 . . . . 5.69 110.879 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 109.78 42.23 1.24 Allowed Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 121.039 -0.6 . . . . 5.87 111.614 -179.45 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -129.49 153.46 80.65 Favored Pre-proline 0 C--N 1.325 -0.464 0 N-CA-C 110.527 -0.175 . . . . 4.83 110.527 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -83.82 160.07 14.05 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 122.724 2.283 . . . . 4.72 112.612 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.462 ' O ' HG12 ' B' ' 408' ' ' VAL . 23.7 ttt180 -61.04 -30.83 70.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.579 -0.737 . . . . 4.16 110.379 179.512 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -56.68 -43.91 80.91 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.563 -0.744 . . . . 4.69 110.714 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -71.82 -42.09 67.42 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.707 -0.679 . . . . 2.99 112.124 -179.081 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 408' ' ' VAL . . . . . 0.518 HG23 HD13 ' B' ' 398' ' ' LEU . 4.2 p -61.61 -37.3 77.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 111.989 0.366 . . . . 2.06 111.989 -179.131 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 71.9 t -68.94 -48.21 71.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.648 0.261 . . . . 2.89 110.79 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 82.5 mttt -61.3 -44.15 97.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.975 0.417 . . . . 5.05 111.167 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -66.0 -49.59 67.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.915 -0.584 . . . . 2.96 111.725 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 45.3 mt -62.49 -32.38 73.28 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.774 0.657 . . . . 3.45 112.774 -179.152 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 413' ' ' LYS . . . . . 0.452 ' HE2' ' CZ ' ' B' ' 390' ' ' PHE . 61.4 mmtt -69.18 -45.25 70.44 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.923 -0.311 . . . . 5.52 111.721 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 29.0 pt20 -75.28 -26.94 59.15 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.925 0.713 . . . . 5.53 112.925 -178.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 415' ' ' THR . . . . . 0.506 HG21 ' HA ' ' B' ' 422' ' ' ALA . 41.2 p -94.61 -3.28 49.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.084 0.469 . . . . 5.42 111.146 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 61.82 60.85 1.5 Allowed 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.563 0.949 . . . . 6.37 113.563 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 72.03 -24.16 0.7 Allowed Glycine 0 CA--C 1.522 0.5 0 N-CA-C 115.945 1.138 . . . . 4.33 115.945 177.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.37 103.09 2.32 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 122.0 0.905 . . . . 6.25 110.944 -179.543 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 419' ' ' ALA . . . . . 0.595 ' HA ' ' HB3' ' B' ' 422' ' ' ALA . . . -66.24 -20.66 66.18 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 115.023 -0.989 . . . . 4.12 112.69 -178.231 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -61.69 -50.33 72.9 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.481 0.658 . . . . 6.99 109.305 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -80.46 -27.11 37.96 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.546 -0.752 . . . . 7.48 109.823 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 422' ' ' ALA . . . . . 0.595 ' HB3' ' HA ' ' B' ' 419' ' ' ALA . . . -61.35 -48.09 82.88 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 110.02 -0.363 . . . . 3.68 110.02 178.889 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.418 ' O ' ' HB2' ' B' ' 427' ' ' PHE . . . -65.68 -40.51 92.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.854 -0.612 . . . . 3.8 109.685 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 424' ' ' SER . . . . . 0.545 ' HA ' ' HG3' ' A' ' 72' ' ' ARG . 21.6 m -61.41 -39.39 90.56 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.749 -0.659 . . . . 5.05 111.069 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.69 -46.84 23.99 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.291 -0.413 . . . . 4.36 110.979 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.3 -37.06 76.77 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.988 0.366 . . . . 3.21 111.988 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 427' ' ' PHE . . . . . 0.566 ' CE2' ' HB3' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -77.25 3.15 13.58 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 113.621 0.971 . . . . 5.27 113.621 -178.683 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 29.2 pt20 -56.94 -20.98 26.54 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.251 0.463 . . . . 5.32 112.251 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 14.2 m . . . . . 0 C--O 1.251 1.134 0 CA-C-O 118.61 -0.709 . . . . 5.11 111.328 -179.777 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.456 ' HG2' ' O ' ' A' ' 17' ' ' VAL . 20.8 ptt? . . . . . 0 N--CA 1.481 1.094 0 CA-C-O 120.577 0.227 . . . . 1.65 110.423 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -109.28 138.17 46.04 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 111.967 0.358 . . . . 1.92 111.967 -179.341 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 16.0 pt -130.32 159.38 42.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.779 -0.646 . . . . 1.48 109.534 178.285 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -121.03 123.65 42.91 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.75 0.309 . . . . 2.17 110.574 -179.417 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.4 t -105.42 127.22 60.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.451 -0.34 . . . . 1.65 111.008 -179.824 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.1 mmtp -92.65 128.3 38.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.282 -0.417 . . . . 3.16 110.829 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.436 HG23 HD23 ' A' ' 69' ' ' LEU . 0.2 OUTLIER -105.06 164.76 11.56 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.224 -0.444 . . . . 2.17 110.751 179.796 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.402 ' HA ' HD23 ' A' ' 8' ' ' LEU . 10.5 mt -64.12 -15.56 59.95 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.413 0.523 . . . . 3.05 112.413 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -90.79 5.23 49.19 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.936 0.398 . . . . 2.7 110.632 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.13 3.97 90.58 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.858 -0.687 . . . . 2.64 111.416 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -75.11 148.41 39.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.413 -0.393 . . . . 2.34 111.037 -179.507 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.9 m -119.3 108.19 14.31 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.802 -0.814 . . . . 2.31 108.802 178.736 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 17.9 mt -92.49 126.51 44.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.33 -0.396 . . . . 1.83 111.466 -178.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.0 122.6 34.66 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.196 -0.668 . . . . 2.02 109.196 178.874 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 76.2 mt -122.25 137.94 54.66 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 112.429 0.529 . . . . 1.33 112.429 -178.795 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -90.78 108.5 19.87 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.259 -1.015 . . . . 2.4 108.259 178.432 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.456 ' O ' ' HG2' ' A' ' 1' ' ' MET . 10.9 m -139.49 173.82 10.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.048 0.451 . . . . 1.25 111.056 -178.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 36.5 mm-40 -138.93 157.31 71.8 Favored Pre-proline 0 C--N 1.32 -0.708 0 N-CA-C 107.923 -1.14 . . . . 1.85 107.923 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.772 ' HA ' ' HB2' ' A' ' 56' ' ' LEU . 88.2 Cg_exo -50.1 -33.04 33.73 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.749 2.299 . . . . 1.78 112.883 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.5 m -74.36 -10.17 59.32 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.799 0.666 . . . . 1.8 112.799 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -77.33 135.46 38.38 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.85 -0.426 . . . . 1.23 109.85 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -86.16 150.12 24.63 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.538 -0.301 . . . . 1.44 110.945 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.421 HG13 ' HB3' ' A' ' 50' ' ' LEU . 43.5 mm -55.66 -36.06 41.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-O 121.033 0.444 . . . . 0.99 110.427 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.447 ' HB2' ' HB3' ' A' ' 52' ' ' ASP . 20.4 tt0 -59.42 -41.37 89.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.581 -0.736 . . . . 2.22 110.695 179.417 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -71.6 -34.84 70.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.032 -0.531 . . . . 1.23 110.679 -179.568 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.8 t -60.62 -42.61 92.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.069 -0.514 . . . . 0.64 109.725 179.004 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.522 ' HG2' HD12 ' A' ' 43' ' ' LEU . 37.2 mtmt -62.74 -36.39 82.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.926 -0.579 . . . . 1.32 110.63 179.37 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.45 -35.54 80.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.985 -0.552 . . . . 1.08 110.55 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -67.74 -37.34 82.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.018 -0.537 . . . . 1.08 109.909 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 54.2 mt -70.99 -33.05 50.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.027 -0.533 . . . . 1.31 110.196 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.741 ' HG3' ' HD3' ' A' ' 38' ' ' PRO . 1.7 tt0 -64.84 -34.6 78.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.943 -0.571 . . . . 1.93 110.803 179.69 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -81.18 -36.2 30.45 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.291 -0.413 . . . . 2.05 111.157 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 75.6 mttt -76.48 -55.38 5.58 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.399 0.518 . . . . 2.17 112.399 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 55.7 mm-40 -85.74 -42.29 14.35 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.118 0.414 . . . . 2.14 112.118 -178.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 105.55 8.05 35.81 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.614 -0.803 . . . . 2.01 111.361 -179.097 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 24.9 mt -89.58 121.09 69.5 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.73 -0.47 . . . . 1.83 109.73 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.463 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 55.1 Cg_exo -54.39 135.32 65.26 Favored 'Trans proline' 0 C--N 1.342 0.231 0 C-N-CA 122.907 2.405 . . . . 2.04 111.409 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.741 ' HD3' ' HG3' ' A' ' 31' ' ' GLN . 32.2 Cg_exo -59.23 -22.39 64.65 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 123.302 2.668 . . . . 1.52 112.373 -179.045 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -77.4 -23.21 50.7 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.928 -0.578 . . . . 2.95 110.882 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -102.56 7.74 40.0 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.119 0.485 . . . . 2.56 110.634 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -91.34 176.16 6.66 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.472 -0.785 . . . . 1.4 110.475 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.458 ' O ' ' HA ' ' A' ' 69' ' ' LEU . 0.0 OUTLIER -160.37 94.51 1.08 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.85 -0.796 . . . . 2.65 108.85 179.38 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.522 HD12 ' HG2' ' A' ' 27' ' ' LYS . 16.8 mt -100.18 123.19 44.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.094 0.473 . . . . 1.02 112.263 -178.899 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.667 HG22 ' HA ' ' A' ' 49' ' ' GLN . 20.0 pt -132.78 163.07 38.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.706 -0.679 . . . . 2.14 109.687 178.285 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.45 ' CB ' HD21 ' A' ' 50' ' ' LEU . 74.7 t80 -130.09 112.74 13.72 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.465 -0.334 . . . . 1.71 110.281 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.58 35.11 22.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.791 -0.641 . . . . 2.1 111.98 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.3 -17.67 56.57 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.771 -0.728 . . . . 1.84 113.249 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -95.39 126.27 40.58 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.112 -0.329 . . . . 3.05 110.112 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.667 ' HA ' HG22 ' A' ' 44' ' ' ILE . 0.9 OUTLIER -67.14 151.08 48.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.054 0.454 . . . . 2.3 111.705 -178.977 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.45 HD21 ' CB ' ' A' ' 45' ' ' PHE . 18.9 mt -108.64 132.52 53.82 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.574 -0.739 . . . . 1.17 110.206 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.783 ' HB2' ' HG2' ' A' ' 54' ' ' ARG . 46.9 mt-10 -86.85 146.78 26.08 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.401 -0.363 . . . . 2.65 110.667 179.462 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.447 ' HB3' ' HB2' ' A' ' 24' ' ' GLU . 9.0 m-20 -61.76 -34.76 76.43 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 112.713 0.634 . . . . 1.83 112.713 -178.816 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -85.12 14.23 50.56 Favored Glycine 0 N--CA 1.453 -0.217 0 C-N-CA 120.962 -0.637 . . . . 1.82 113.043 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.783 ' HG2' ' HB2' ' A' ' 51' ' ' GLU . 30.1 mmt180 -112.45 152.0 29.23 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.027 0.441 . . . . 2.69 110.456 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.501 ' HB ' ' O ' ' A' ' 19' ' ' PRO . 68.4 p -99.19 175.26 5.95 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 108.891 -0.781 . . . . 1.71 108.891 179.232 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.772 ' HB2' ' HA ' ' A' ' 19' ' ' PRO . 88.0 mt -68.93 -31.54 70.5 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.357 -0.608 . . . . 1.49 109.357 178.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.89 -28.53 68.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.555 -0.748 . . . . 1.94 110.632 178.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' A' ' 55' ' ' THR . 2.4 m-20 -60.34 -32.41 71.23 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.112 -0.495 . . . . 2.03 111.118 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -108.82 12.0 25.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.233 -0.44 . . . . 1.76 111.58 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 61.4 30.21 18.85 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.911 -0.586 . . . . 2.96 111.707 -179.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.453 ' HB ' ' HB3' ' A' ' 56' ' ' LEU . 86.4 mt -74.42 116.59 17.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 109.375 -0.602 . . . . 1.65 109.375 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -109.5 -163.24 0.85 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.953 -0.567 . . . . 2.66 110.306 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.9 pttt -73.86 149.43 41.56 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.677 -0.238 . . . . 3.22 110.815 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 69.41 19.15 7.72 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.711 0.634 . . . . 3.12 112.711 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.417 ' HB3' ' HE1' ' A' ' 45' ' ' PHE . 20.3 m -82.3 146.76 29.26 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.784 0.326 . . . . 1.83 110.328 179.265 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 10.3 m -105.33 120.9 42.72 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.045 0.45 . . . . 2.03 111.539 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.5 mp -102.62 147.27 27.0 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.7 -0.682 . . . . 1.41 109.461 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.57 ' HB2' ' CG1' ' A' ' 44' ' ' ILE . 23.9 m80 -105.57 129.78 53.76 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.579 -0.282 . . . . 2.76 110.936 -179.204 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.458 ' HA ' ' O ' ' A' ' 42' ' ' ARG . 29.1 tp -123.4 121.86 36.82 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.254 -0.43 . . . . 1.54 110.781 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.651 HG22 ' HB1' ' B' ' 423' ' ' ALA . 0.5 OUTLIER -116.88 153.41 18.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.311 -0.404 . . . . 1.79 110.917 179.612 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 95.9 mt -85.89 131.23 34.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.077 0.465 . . . . 2.43 111.203 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.561 ' HA ' ' HB3' ' B' ' 424' ' ' SER . 12.1 ttt180 -106.16 80.01 1.46 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.858 -0.61 . . . . 3.19 109.501 178.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.622 HD11 ' HB3' ' B' ' 420' ' ' GLU . 77.6 mt -63.18 150.06 43.86 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.726 -0.67 . . . . 2.99 111.417 -179.503 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 74' ' ' ARG . 14.5 mmt85 . . . . . 0 C--N 1.322 -0.598 0 CA-C-N 116.072 -0.513 . . . . 3.67 110.087 179.782 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 390' ' ' PHE . . . . . 0.768 ' HB3' HD11 ' B' ' 395' ' ' ILE . 57.4 m-85 . . . . . 0 N--CA 1.455 -0.203 0 N-CA-C 110.228 -0.286 . . . . 2.51 110.228 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_exo -72.67 121.09 7.1 Favored 'Trans proline' 0 C--O 1.235 0.347 0 C-N-CA 123.054 2.503 . . . . 3.77 111.968 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 392' ' ' GLU . . . . . 0.634 ' HB3' ' HE3' ' B' ' 396' ' ' LYS . 18.4 mt-10 -51.19 -50.34 59.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.873 -0.603 . . . . 5.36 112.514 -179.366 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -55.16 -50.12 70.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.025 -0.534 . . . . 6.89 111.918 -179.082 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 2.1 m -61.18 -45.18 95.67 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.032 -0.531 . . . . 4.2 111.29 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 395' ' ' ILE . . . . . 0.768 HD11 ' HB3' ' B' ' 390' ' ' PHE . 75.0 mt -60.64 -48.71 87.48 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.109 0 CA-C-O 120.662 0.268 . . . . 3.8 110.848 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 396' ' ' LYS . . . . . 0.634 ' HE3' ' HB3' ' B' ' 392' ' ' GLU . 73.3 mttt -58.28 -41.27 84.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 6.27 111.925 -179.461 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -68.33 -36.8 79.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.841 0.353 . . . . 6.91 110.723 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 83.4 mt -68.43 -24.28 64.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.285 -0.416 . . . . 4.31 111.051 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 399' ' ' MET . . . . . 0.615 ' HG2' ' O ' ' B' ' 395' ' ' ILE . 23.1 mmt -68.36 -25.11 64.92 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.04 0.448 . . . . 5.8 110.63 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -73.96 -11.43 60.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.886 -0.597 . . . . 7.71 111.416 -179.353 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 74.9 mt -86.03 16.96 3.79 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.035 0.383 . . . . 5.69 112.035 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 62.53 47.3 90.36 Favored Glycine 0 CA--C 1.518 0.227 0 C-N-CA 121.07 -0.586 . . . . 5.87 112.589 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -134.51 150.3 73.36 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-O 120.361 0.124 . . . . 4.83 110.802 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 404' ' ' PRO . . . . . 0.466 ' HG2' ' HB2' ' B' ' 407' ' ' ALA . 52.4 Cg_endo -69.49 153.35 70.29 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.955 2.437 . . . . 4.72 112.204 179.557 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.467 ' HA ' ' HE3' ' B' ' 399' ' ' MET . 25.9 ttt180 -68.76 -41.0 79.47 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.123 0.416 . . . . 4.16 112.123 -178.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -59.6 -37.31 78.24 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.405 -0.361 . . . . 4.69 111.527 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 407' ' ' ALA . . . . . 0.466 ' HB2' ' HG2' ' B' ' 404' ' ' PRO . . . -61.72 -39.38 91.3 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.244 -0.434 . . . . 2.99 110.518 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 55.2 t -66.09 -40.75 88.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.85 -0.614 . . . . 2.06 110.11 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 88.6 t -60.24 -46.01 95.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.033 -0.531 . . . . 2.89 110.189 179.099 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 19.2 mttp -67.69 -39.3 84.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.984 -0.553 . . . . 5.05 111.155 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -65.81 -49.2 69.12 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.181 -0.463 . . . . 2.96 111.309 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 46.5 mt -63.63 -30.7 71.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.452 -0.34 . . . . 3.45 111.375 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -64.66 -49.06 72.48 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.32 -0.4 . . . . 5.52 111.041 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -80.05 -9.73 59.72 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.207 0.817 . . . . 5.53 113.207 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 31.4 p -107.75 -4.99 17.59 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.759 0.314 . . . . 5.42 110.96 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 55.1 m-80 64.91 55.4 1.19 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.857 -0.611 . . . . 6.37 112.501 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 72.71 -6.94 10.05 Favored Glycine 0 CA--C 1.519 0.287 0 CA-C-N 115.864 -0.607 . . . . 4.33 114.253 178.625 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -67.8 93.99 0.43 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.018 0.437 . . . . 6.25 110.15 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -59.08 -35.88 74.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.527 -0.76 . . . . 4.12 112.287 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 420' ' ' GLU . . . . . 0.622 ' HB3' HD11 ' A' ' 73' ' ' LEU . 12.7 mt-10 -71.94 -43.79 64.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.883 0.373 . . . . 6.99 110.674 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -67.78 -39.68 84.04 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.189 -0.46 . . . . 7.48 109.861 179.582 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -61.73 -38.99 89.99 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.779 -0.646 . . . . 3.68 110.436 179.446 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.651 ' HB1' HG22 ' A' ' 70' ' ' VAL . . . -57.3 -48.8 77.99 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.009 -0.541 . . . . 3.8 110.613 179.445 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 424' ' ' SER . . . . . 0.561 ' HB3' ' HA ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -63.12 -30.88 71.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.053 -0.521 . . . . 5.05 111.612 179.123 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 425' ' ' LEU . . . . . 0.598 ' O ' ' HG2' ' B' ' 428' ' ' GLN . 3.4 mm? -81.82 -50.25 9.44 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 113.747 1.017 . . . . 4.36 113.747 -178.556 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.3 pp -62.63 -34.25 76.66 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.126 0.788 . . . . 3.21 113.126 -178.582 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 427' ' ' PHE . . . . . 0.442 ' HD2' ' HG2' ' A' ' 42' ' ' ARG . 2.0 m-85 -67.04 -13.03 61.52 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.341 0.867 . . . . 5.27 113.341 -179.467 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 428' ' ' GLN . . . . . 0.598 ' HG2' ' O ' ' B' ' 425' ' ' LEU . 3.2 pt20 -77.39 -18.63 57.15 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 120.809 -0.356 . . . . 5.32 111.811 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 6.6 m . . . . . 0 C--O 1.247 0.954 0 CA-C-O 118.676 -0.678 . . . . 5.11 110.9 -179.372 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.5 ' HB2' ' HB3' ' A' ' 63' ' ' LYS . 26.0 ptt? . . . . . 0 N--CA 1.481 1.099 0 N-CA-C 110.204 -0.295 . . . . 1.65 110.204 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' GLN . . . . . 0.858 HE22 ' HG2' ' A' ' 16' ' ' GLU . 89.2 mm-40 -102.27 135.33 44.06 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.914 0.388 . . . . 1.92 111.582 -179.42 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.3 pt -126.63 151.93 33.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.027 -0.533 . . . . 1.48 109.916 178.585 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -108.93 124.75 51.16 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.673 -0.239 . . . . 2.17 111.167 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.1 t -111.8 118.83 58.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.42 -0.585 . . . . 1.65 109.42 179.109 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -102.09 132.68 47.81 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.0 0.429 . . . . 3.16 111.727 -179.015 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.404 ' OG1' ' HB3' ' A' ' 11' ' ' LYS . 26.5 p -99.06 175.85 5.77 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.959 -0.564 . . . . 2.17 110.224 179.728 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.476 HD21 HG22 ' A' ' 70' ' ' VAL . 92.8 mt -79.28 10.61 3.52 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.914 0.388 . . . . 3.05 111.7 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -110.04 3.52 20.43 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.318 -0.401 . . . . 2.7 110.71 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 80.18 24.88 58.62 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.796 -0.716 . . . . 2.64 111.783 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.662 ' HE2' HG12 ' A' ' 13' ' ' ILE . 81.5 tttt -106.35 134.88 48.79 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.584 0.23 . . . . 2.34 110.499 -179.616 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.1 m -115.64 109.48 17.81 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.961 0.41 . . . . 2.31 110.755 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.662 HG12 ' HE2' ' A' ' 11' ' ' LYS . 7.5 mt -95.26 138.48 20.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.893 -0.594 . . . . 1.83 110.428 -179.499 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.5 m -101.94 115.09 29.78 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.761 -0.459 . . . . 2.02 109.761 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.434 HD11 HG12 ' A' ' 30' ' ' ILE . 55.1 mt -105.07 143.32 33.41 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.059 0.456 . . . . 1.33 112.124 -179.078 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.858 ' HG2' HE22 ' A' ' 2' ' ' GLN . 14.9 mt-10 -98.97 101.51 12.93 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.46 -0.791 . . . . 2.4 109.609 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 16.3 m -138.2 -179.0 2.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.991 -0.549 . . . . 1.25 110.821 -178.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.418 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 27.4 mm-40 -132.78 157.72 77.62 Favored Pre-proline 0 C--N 1.323 -0.584 0 N-CA-C 109.035 -0.728 . . . . 1.85 109.035 179.098 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.583 ' HA ' ' HB2' ' A' ' 56' ' ' LEU . 74.6 Cg_exo -53.34 -29.67 48.95 Favored 'Trans proline' 0 CA--C 1.533 0.467 0 C-N-CA 122.882 2.388 . . . . 1.78 113.058 -179.638 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.98 -5.48 48.8 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.14 0.422 . . . . 1.8 112.14 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.418 ' HB2' ' O ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -74.07 144.04 45.18 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.029 0.442 . . . . 1.23 110.757 -179.693 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -93.48 145.13 24.73 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.798 -0.637 . . . . 1.44 110.075 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.559 HG23 HD12 ' A' ' 43' ' ' LEU . 46.1 mm -53.34 -42.77 49.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 O-C-N 123.166 0.291 . . . . 0.99 111.469 -179.681 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -56.59 -44.34 80.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.366 -0.379 . . . . 2.22 110.7 179.431 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.483 ' O ' ' HG3' ' A' ' 29' ' ' LYS . 66.5 t30 -67.27 -37.31 83.26 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.961 -0.563 . . . . 1.23 110.667 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 87.2 t -61.37 -43.49 96.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.086 -0.506 . . . . 0.64 110.462 179.295 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.8 mtmt -63.33 -34.17 77.12 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.209 -0.451 . . . . 1.32 110.976 179.507 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -64.96 -32.81 74.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.086 -0.506 . . . . 1.08 110.132 179.233 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 21.4 mttt -71.04 -37.43 72.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.009 -0.542 . . . . 1.08 109.827 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.434 HG12 HD11 ' A' ' 15' ' ' LEU . 59.3 mt -66.77 -38.23 81.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 109.084 -0.71 . . . . 1.31 109.084 178.826 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -65.63 -37.34 86.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.753 -0.658 . . . . 1.93 110.596 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -67.72 -37.17 81.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.219 -0.446 . . . . 2.05 112.019 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -87.3 -54.48 4.28 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 113.046 0.758 . . . . 2.17 113.046 -178.648 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -77.36 -35.85 54.16 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.702 0.63 . . . . 2.14 112.702 -178.266 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 91.57 13.77 57.83 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.454 -0.879 . . . . 2.01 111.835 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.0 mt -95.17 123.77 56.01 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 110.075 -0.343 . . . . 1.83 110.075 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -52.98 137.81 61.84 Favored 'Trans proline' 0 CA--C 1.532 0.378 0 C-N-CA 123.083 2.522 . . . . 2.04 112.33 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -62.57 -18.7 64.99 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.943 2.429 . . . . 1.52 111.974 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -71.13 -25.4 62.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.953 -0.567 . . . . 2.95 110.238 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -102.15 6.65 40.91 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.043 -0.526 . . . . 2.56 110.368 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.507 ' HB3' HD11 ' A' ' 69' ' ' LEU . 75.5 mt-30 -98.6 114.95 27.61 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.924 -0.58 . . . . 1.4 111.661 -179.152 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.418 ' HD2' ' HB2' ' A' ' 72' ' ' ARG . 66.6 mtp180 -116.59 101.59 8.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.241 -0.436 . . . . 2.65 109.979 178.318 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.559 HD12 HG23 ' A' ' 23' ' ' ILE . 21.7 mt -77.33 128.26 33.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.894 0.378 . . . . 1.02 111.26 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.436 HD13 ' HZ ' ' B' ' 403' ' ' PHE . 53.5 mt -124.88 137.63 56.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.669 -0.696 . . . . 2.14 110.772 -179.498 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.48 ' HB3' HD21 ' A' ' 50' ' ' LEU . 40.4 t80 -132.7 113.22 12.73 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.038 -0.727 . . . . 1.71 109.038 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 63.16 30.36 16.01 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.22 -0.446 . . . . 2.1 112.01 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 86.04 4.06 84.7 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.871 -0.681 . . . . 1.84 113.089 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 41.6 mtmt -116.49 136.75 52.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.766 0.283 . . . . 3.05 110.906 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.571 ' HB2' ' CZ ' ' B' ' 427' ' ' PHE . 8.1 tt0 -73.6 145.87 45.1 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.199 -0.455 . . . . 2.3 110.529 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.48 HD21 ' HB3' ' A' ' 45' ' ' PHE . 26.1 mt -105.33 140.4 38.52 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.297 -0.41 . . . . 1.17 110.594 179.784 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.59 ' HB2' ' CG ' ' A' ' 54' ' ' ARG . 43.5 mt-10 -80.47 138.41 36.57 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.715 -0.476 . . . . 2.65 109.715 179.199 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.457 ' HA ' ' HB ' ' A' ' 23' ' ' ILE . 71.0 m-20 -64.77 -28.37 69.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.948 0.404 . . . . 1.83 111.06 -179.496 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -86.37 22.85 11.23 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 115.82 -0.627 . . . . 1.82 112.808 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.59 ' CG ' ' HB2' ' A' ' 51' ' ' GLU . 37.0 mmt180 -120.86 160.83 22.62 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.911 -0.403 . . . . 2.69 109.911 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.517 ' O ' ' HB2' ' A' ' 58' ' ' ASP . 35.2 p -103.8 174.44 5.87 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.922 -0.399 . . . . 1.71 109.922 179.287 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.583 ' HB2' ' HA ' ' A' ' 19' ' ' PRO . 85.8 mt -66.86 -35.99 81.31 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.168 0.508 . . . . 1.49 110.346 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.4 m -65.88 -21.85 66.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.828 -0.624 . . . . 1.94 110.339 178.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.517 ' HB2' ' O ' ' A' ' 55' ' ' THR . 4.7 m-20 -68.14 -21.51 64.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.784 -0.644 . . . . 2.03 112.158 -179.431 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -120.98 16.48 11.7 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.705 0.288 . . . . 1.76 111.271 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 60.99 28.71 18.49 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.729 -0.669 . . . . 2.96 111.617 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 67.2 mt -78.76 114.53 19.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.212 -0.449 . . . . 1.65 110.658 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -107.92 -165.99 1.1 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.753 -0.658 . . . . 2.66 110.117 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.709 ' HD2' ' HG3' ' A' ' 64' ' ' GLU . 0.1 OUTLIER -73.77 152.57 40.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.695 -0.23 . . . . 3.22 110.985 -179.905 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.709 ' HG3' ' HD2' ' A' ' 63' ' ' LYS . 46.6 mt-10 73.16 1.7 4.1 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 112.688 0.625 . . . . 3.12 112.688 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.0 m -74.06 146.24 43.83 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.755 0.312 . . . . 1.83 110.963 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.0 m -108.93 129.13 55.42 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.814 0.34 . . . . 2.03 111.192 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.2 mp -115.97 152.44 33.49 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.81 -0.811 . . . . 1.41 108.81 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 70.5 m80 -111.04 150.54 29.19 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.645 0.259 . . . . 2.76 111.193 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.507 HD11 ' HB3' ' A' ' 41' ' ' GLN . 23.2 tp -129.84 109.79 11.21 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.314 -0.403 . . . . 1.54 111.245 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.476 HG22 HD21 ' A' ' 8' ' ' LEU . 16.0 t -96.18 126.87 48.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 109.901 -0.407 . . . . 1.79 109.901 179.016 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 63.9 mt -74.46 112.34 10.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.947 -0.57 . . . . 2.43 109.903 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.432 ' HA ' ' OG ' ' B' ' 424' ' ' SER . 29.3 ttt180 -85.37 103.25 14.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.119 -0.491 . . . . 3.19 111.236 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 77.9 mt -73.77 126.25 29.95 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.007 -0.542 . . . . 2.99 109.796 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 74' ' ' ARG . 11.3 mmt180 . . . . . 0 C--N 1.324 -0.514 0 CA-C-O 120.89 0.376 . . . . 3.67 111.398 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 390' ' ' PHE . . . . . 0.619 ' HB3' ' HG ' ' B' ' 412' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.451 -0.383 0 CA-C-O 120.721 0.296 . . . . 2.51 110.884 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -64.77 141.56 72.5 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.656 2.237 . . . . 3.77 111.137 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 392' ' ' GLU . . . . . 0.61 ' O ' ' HG2' ' B' ' 396' ' ' LYS . 2.9 mm-40 -53.96 -41.08 67.41 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.605 0.594 . . . . 5.36 112.605 -179.187 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 42.4 tt0 -55.37 -52.58 63.07 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.932 0.396 . . . . 6.89 111.72 -179.701 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.44 -36.67 83.15 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.195 -0.457 . . . . 4.2 110.974 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 395' ' ' ILE . . . . . 0.45 ' O ' ' HG2' ' B' ' 399' ' ' MET . 93.1 mt -63.17 -42.37 96.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.075 -0.512 . . . . 3.8 110.317 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 396' ' ' LYS . . . . . 0.61 ' HG2' ' O ' ' B' ' 392' ' ' GLU . 24.1 mmtp -58.61 -41.2 85.31 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.481 -0.327 . . . . 6.27 110.913 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -63.48 -41.71 98.57 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.151 -0.477 . . . . 6.91 110.794 179.563 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 77.8 mt -73.44 -27.92 61.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.056 -0.52 . . . . 4.31 111.646 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 399' ' ' MET . . . . . 0.45 ' HG2' ' O ' ' B' ' 395' ' ' ILE . 31.4 mmt -67.62 -41.9 83.22 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.425 -0.352 . . . . 5.8 111.17 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -61.51 -24.39 66.57 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.118 -0.492 . . . . 7.71 111.699 -179.295 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 44.9 mt -68.93 -17.5 63.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 5.69 111.0 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 90.93 34.66 7.56 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.719 -0.753 . . . . 5.87 112.36 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 403' ' ' PHE . . . . . 0.436 ' HZ ' HD13 ' A' ' 44' ' ' ILE . 21.2 m-85 -113.8 149.88 42.5 Favored Pre-proline 0 C--N 1.325 -0.47 0 N-CA-C 110.531 -0.174 . . . . 4.83 110.531 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -67.03 142.62 62.46 Favored 'Trans proline' 0 CA--C 1.531 0.329 0 C-N-CA 122.474 2.116 . . . . 4.72 111.9 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -65.35 -33.81 76.83 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.394 -0.366 . . . . 4.16 111.447 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -62.56 -38.69 91.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.266 -0.424 . . . . 4.69 110.764 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -65.34 -33.94 77.14 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.163 0.506 . . . . 2.99 109.678 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 54.0 t -63.99 -41.73 93.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.347 -0.842 . . . . 2.06 109.432 179.081 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 409' ' ' VAL . . . . . 0.477 HG13 ' CZ ' ' B' ' 390' ' ' PHE . 88.0 t -59.93 -47.57 91.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.916 -0.584 . . . . 2.89 110.276 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 34.3 mttp -60.3 -47.5 85.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.663 -0.698 . . . . 5.05 111.079 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -67.18 -44.91 78.5 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.746 -0.661 . . . . 2.96 111.96 -178.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.619 ' HG ' ' HB3' ' B' ' 390' ' ' PHE . 2.6 mm? -63.93 -31.26 72.39 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.94 0.348 . . . . 3.45 111.94 -179.359 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 413' ' ' LYS . . . . . 0.413 ' HA ' ' HD3' ' B' ' 413' ' ' LYS . 32.3 mmtt -71.58 -45.91 60.85 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.801 0.297 . . . . 5.52 111.801 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -72.05 -27.82 62.94 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.196 0.443 . . . . 5.53 112.196 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 415' ' ' THR . . . . . 0.778 ' HB ' ' HB2' ' B' ' 418' ' ' ASN . 39.5 p -92.4 -14.48 28.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.816 0.341 . . . . 5.42 111.238 -179.897 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 59.81 62.42 1.69 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 113.039 0.755 . . . . 6.37 113.039 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 86.33 -12.21 61.25 Favored Glycine 0 CA--C 1.518 0.248 0 C-N-CA 120.523 -0.846 . . . . 4.33 114.051 178.119 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 418' ' ' ASN . . . . . 0.778 ' HB2' ' HB ' ' B' ' 415' ' ' THR . 33.4 m-80 -73.43 79.76 1.4 Allowed 'General case' 0 C--N 1.321 -0.668 0 O-C-N 122.348 -0.501 . . . . 6.25 110.117 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -58.62 -42.32 87.95 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.155 -0.475 . . . . 4.12 112.135 -179.012 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -65.11 -37.71 88.33 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.295 0.569 . . . . 6.99 110.542 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -73.34 -38.16 65.86 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.659 -0.7 . . . . 7.48 109.163 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -61.88 -42.65 99.31 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.549 -0.751 . . . . 3.68 110.408 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -58.93 -42.11 88.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.129 0.49 . . . . 3.8 110.09 179.095 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 424' ' ' SER . . . . . 0.432 ' OG ' ' HA ' ' A' ' 72' ' ' ARG . 71.6 m -70.49 -37.86 74.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.85 -0.614 . . . . 5.05 110.867 179.15 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -71.38 -48.85 47.44 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 113.058 0.762 . . . . 4.36 113.058 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.6 pp -67.3 -34.51 77.52 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.154 0.427 . . . . 3.21 112.154 -178.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 427' ' ' PHE . . . . . 0.571 ' CZ ' ' HB2' ' A' ' 49' ' ' GLN . 3.4 t80 -89.08 1.62 55.31 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.216 0.45 . . . . 5.27 112.216 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -59.9 -19.67 52.9 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.842 0.353 . . . . 5.32 111.698 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 41.0 m . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.244 -0.884 . . . . 5.11 109.981 179.237 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.403 ' HB2' ' HB3' ' A' ' 63' ' ' LYS . 25.0 ptt? . . . . . 0 N--CA 1.483 1.183 0 N-CA-C 110.092 -0.336 . . . . 1.65 110.092 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 77.1 mm-40 -107.42 138.68 43.18 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.659 0.266 . . . . 1.92 110.71 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 32.3 pt -124.15 163.64 23.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.439 -0.346 . . . . 1.48 110.092 179.095 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -117.65 122.79 44.52 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.787 0.327 . . . . 2.17 110.914 -179.593 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 56.1 t -106.74 122.39 60.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.287 -0.415 . . . . 1.65 109.988 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -109.52 137.33 47.52 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.197 0.523 . . . . 3.16 111.395 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.27 159.08 16.91 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.675 -0.693 . . . . 2.17 109.554 179.298 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.471 HD21 HD11 ' B' ' 401' ' ' LEU . 55.8 mt -64.57 -6.84 8.4 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.112 0.412 . . . . 3.05 112.112 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.9 p -88.96 -10.52 47.43 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.058 0.456 . . . . 2.7 110.338 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.47 -9.02 52.78 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.97 -0.559 . . . . 2.64 112.19 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -68.18 143.6 55.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.873 0.368 . . . . 2.34 111.514 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.7 m -136.3 111.6 9.11 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.457 -0.571 . . . . 2.31 109.457 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.5 mt -112.43 148.69 15.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.534 -0.303 . . . . 1.83 110.717 -178.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 7.9 m -96.83 142.41 28.86 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.298 -0.63 . . . . 2.02 109.298 178.589 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 17.9 mt -133.41 131.19 39.68 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.843 0.354 . . . . 1.33 111.464 179.706 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -85.99 109.45 18.79 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.786 -0.643 . . . . 2.4 109.316 178.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.719 HG12 ' HE3' ' A' ' 29' ' ' LYS . 16.8 m -134.0 -169.8 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.93 -0.577 . . . . 1.25 110.732 -179.141 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.441 ' O ' HD12 ' A' ' 56' ' ' LEU . 11.7 mm-40 -153.26 153.96 30.11 Favored Pre-proline 0 C--N 1.322 -0.621 0 N-CA-C 107.408 -1.33 . . . . 1.85 107.408 178.848 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_exo -53.64 -31.67 61.19 Favored 'Trans proline' 0 CA--C 1.528 0.199 0 C-N-CA 122.208 1.939 . . . . 1.78 112.122 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.5 1.42 22.41 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.046 0.758 . . . . 1.8 113.046 -179.055 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -89.0 137.79 31.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.83 0.347 . . . . 1.23 110.161 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.0 OUTLIER -83.07 154.2 24.51 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.247 -0.433 . . . . 1.44 111.084 -179.467 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 34.3 mm -56.3 -41.32 70.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.369 -0.378 . . . . 0.99 110.9 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -57.45 -37.47 72.9 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.108 -0.496 . . . . 2.22 110.677 179.09 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -67.81 -32.5 73.1 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.076 -0.511 . . . . 1.23 110.435 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.549 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 46.2 t -69.28 -40.68 80.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 108.91 -0.774 . . . . 0.64 108.91 178.404 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.566 ' HE3' ' HB2' ' A' ' 41' ' ' GLN . 6.7 mmmm -59.03 -43.28 91.6 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.527 -0.761 . . . . 1.32 109.871 179.092 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.01 -41.44 96.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.485 -0.78 . . . . 1.08 110.7 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.719 ' HE3' HG12 ' A' ' 17' ' ' VAL . 28.4 mtmm -65.11 -36.84 85.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.008 -0.542 . . . . 1.08 110.944 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.408 HG13 ' O ' ' A' ' 26' ' ' VAL . 81.7 mt -66.48 -38.06 80.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 109.973 -0.38 . . . . 1.31 109.973 178.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -68.7 -31.8 71.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.036 0.446 . . . . 1.93 110.481 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -74.64 -22.98 58.61 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.843 0.354 . . . . 2.05 111.28 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -97.45 -43.52 7.24 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.216 0.45 . . . . 2.17 112.216 -179.669 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 53.7 mm-40 -98.12 -31.27 12.2 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.131 0.789 . . . . 2.14 113.131 -178.633 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 91.75 5.47 66.52 Favored Glycine 0 C--N 1.324 -0.134 0 C-N-CA 120.533 -0.841 . . . . 2.01 112.152 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 65.7 mt -84.96 125.09 71.52 Favored Pre-proline 0 C--N 1.328 -0.362 0 N-CA-C 110.395 -0.224 . . . . 1.83 110.395 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_exo -55.09 140.93 80.55 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.875 2.383 . . . . 2.04 111.737 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -64.1 -13.0 35.15 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.873 2.382 . . . . 1.52 112.432 -179.31 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.58 -23.93 53.49 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.031 -0.531 . . . . 2.95 110.098 179.471 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.457 ' HA ' ' HB3' ' A' ' 72' ' ' ARG . 83.4 mt-30 -100.16 -15.93 17.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.85 -0.614 . . . . 2.56 110.555 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.566 ' HB2' ' HE3' ' A' ' 27' ' ' LYS . 79.8 mt-30 -75.84 125.05 28.35 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.96 -0.564 . . . . 1.4 111.197 -179.655 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 57.2 mtt180 -128.62 103.46 7.11 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.205 -0.452 . . . . 2.65 109.921 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.455 ' HB3' HD12 ' A' ' 50' ' ' LEU . 80.8 mt -90.06 132.11 35.57 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.343 0.498 . . . . 1.02 112.343 -178.598 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.501 HG12 ' CE1' ' B' ' 427' ' ' PHE . 1.1 mt -120.93 141.83 39.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.646 -0.706 . . . . 2.14 109.418 179.088 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.542 ' HB2' HD11 ' A' ' 50' ' ' LEU . 50.0 t80 -128.7 102.72 6.7 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.461 -0.336 . . . . 1.71 110.279 179.192 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 63.23 12.53 6.2 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.825 -0.625 . . . . 2.1 112.629 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 111.15 -6.88 28.9 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.863 -0.684 . . . . 1.84 112.09 -179.647 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 82.8 mttt -91.42 137.29 32.48 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.297 -0.26 . . . . 3.05 110.297 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -76.26 123.21 25.55 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 123.432 0.457 . . . . 2.3 110.244 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.542 HD11 ' HB2' ' A' ' 45' ' ' PHE . 42.8 mt -92.6 122.87 35.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.229 -0.441 . . . . 1.17 110.864 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -93.11 145.43 24.41 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.025 -0.534 . . . . 2.65 110.205 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -58.07 -42.12 84.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 1.83 112.197 -179.117 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.86 41.49 2.59 Favored Glycine 0 CA--C 1.519 0.33 0 C-N-CA 121.339 -0.458 . . . . 1.82 114.201 -178.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -134.58 158.78 43.12 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.263 -0.643 . . . . 2.69 109.263 179.073 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' A' ' 22' ' ' THR . 0.3 OUTLIER -100.7 155.44 17.89 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.912 -0.403 . . . . 1.71 109.912 179.874 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.441 HD12 ' O ' ' A' ' 18' ' ' GLU . 92.2 mt -59.63 -38.32 81.04 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.828 0.346 . . . . 1.49 111.475 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.27 -20.31 65.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.267 -0.424 . . . . 1.94 111.757 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -69.18 -31.91 70.85 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.818 0.342 . . . . 2.03 110.677 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -98.08 9.86 41.83 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.195 -0.457 . . . . 1.76 111.4 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 65.02 29.36 12.22 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.952 -0.567 . . . . 2.96 111.142 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 83.0 mt -77.47 121.09 29.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.988 -0.551 . . . . 1.65 110.249 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -113.24 -164.35 0.91 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.588 -0.733 . . . . 2.66 110.155 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.403 ' HB3' ' HB2' ' A' ' 1' ' ' MET . 56.9 pttt -73.64 147.53 43.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.596 0.236 . . . . 3.22 110.43 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 64.28 28.97 13.87 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.99 0.737 . . . . 3.12 112.99 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 50.4 m -84.38 140.81 31.31 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.577 -0.527 . . . . 1.83 109.577 178.837 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -94.18 114.29 26.38 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.431 -0.35 . . . . 2.03 111.305 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.0 mp -106.52 141.71 37.36 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.158 -0.682 . . . . 1.41 109.158 178.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.427 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 75.0 m80 -106.74 147.21 29.9 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 111.53 0.196 . . . . 2.76 111.53 -179.205 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 27.7 tp -120.8 116.33 25.01 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.095 0.474 . . . . 1.54 111.482 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.486 ' CG2' HD11 ' A' ' 44' ' ' ILE . 0.9 OUTLIER -96.29 143.2 12.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.819 -0.628 . . . . 1.79 110.004 179.104 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 12.4 mt -86.49 134.92 33.63 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.172 -0.467 . . . . 2.43 111.314 -179.077 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.457 ' HB3' ' HA ' ' A' ' 40' ' ' GLN . 0.2 OUTLIER -112.48 129.94 56.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.034 -0.53 . . . . 3.19 110.359 179.303 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.638 HD12 ' HB3' ' B' ' 420' ' ' GLU . 5.9 mt -118.41 155.36 30.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.882 0.372 . . . . 2.99 111.39 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 32.0 mmt180 . . . . . 0 C--N 1.326 -0.431 0 CA-C-N 116.116 -0.493 . . . . 3.67 110.002 178.78 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 . . . . . 0 N--CA 1.455 -0.212 0 N-CA-C 109.733 -0.469 . . . . 2.51 109.733 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -67.52 130.04 21.39 Favored 'Trans proline' 0 C--O 1.235 0.366 0 C-N-CA 122.55 2.167 . . . . 3.77 111.124 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -54.1 -39.23 66.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.164 -0.471 . . . . 5.36 111.038 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 393' ' ' GLN . . . . . 0.418 ' O ' ' HG2' ' B' ' 397' ' ' GLN . 59.1 tt0 -59.38 -51.11 71.33 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.778 -0.647 . . . . 6.89 110.301 179.364 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 26.1 m -59.24 -45.25 91.67 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.907 -0.588 . . . . 4.2 111.091 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 395' ' ' ILE . . . . . 0.482 ' O ' ' HG2' ' B' ' 399' ' ' MET . 78.3 mt -58.09 -49.02 82.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 3.8 110.561 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 85.8 mttt -60.0 -42.26 93.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 6.27 112.001 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 397' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' B' ' 393' ' ' GLN . 21.6 mm-40 -62.87 -41.24 99.31 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.887 0.375 . . . . 6.91 110.981 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 80.8 mt -72.79 -26.49 61.54 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.083 -0.508 . . . . 4.31 111.464 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 399' ' ' MET . . . . . 0.482 ' HG2' ' O ' ' B' ' 395' ' ' ILE . 30.7 mmt -62.35 -40.25 95.77 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.315 -0.402 . . . . 5.8 111.293 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -70.45 -17.79 62.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.865 -0.607 . . . . 7.71 112.138 -178.726 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 401' ' ' LEU . . . . . 0.491 HD22 HD12 ' A' ' 44' ' ' ILE . 94.5 mt -69.51 -16.26 63.41 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.837 0.351 . . . . 5.69 111.75 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 96.87 32.57 6.45 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.711 -0.757 . . . . 5.87 112.178 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -126.4 144.58 49.86 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 110.486 -0.191 . . . . 4.83 110.486 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -72.77 162.78 40.26 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.697 2.265 . . . . 4.72 111.999 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' B' ' 405' ' ' ARG . 14.2 ttt180 -63.51 -28.3 69.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.835 -0.62 . . . . 4.16 111.033 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -56.21 -48.88 75.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.862 -0.608 . . . . 4.69 111.209 179.415 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -64.94 -35.74 82.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.824 -0.625 . . . . 2.99 110.644 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 73.9 t -63.22 -50.54 78.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.823 -0.626 . . . . 2.06 110.796 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 59.8 t -60.2 -44.31 95.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.502 -0.317 . . . . 2.89 111.403 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -64.15 -50.4 68.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.296 -0.411 . . . . 5.05 111.72 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -63.54 -50.04 71.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 2.96 111.703 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -59.59 -30.45 68.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.332 -0.395 . . . . 3.45 111.969 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 23.5 mmtt -67.35 -48.3 67.88 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.418 -0.355 . . . . 5.52 111.128 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 23.8 pt20 -76.09 -30.96 58.48 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 113.147 0.795 . . . . 5.53 113.147 -179.171 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 415' ' ' THR . . . . . 0.512 ' HB ' ' ND2' ' B' ' 418' ' ' ASN . 65.4 p -84.02 -8.14 59.21 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.007 0.432 . . . . 5.42 110.915 179.766 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 61.96 61.1 1.42 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.366 -0.834 . . . . 6.37 112.811 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 74.27 -23.15 1.2 Allowed Glycine 0 CA--C 1.521 0.41 0 CA-C-N 115.493 -0.776 . . . . 4.33 114.928 178.054 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 418' ' ' ASN . . . . . 0.799 HD21 ' HB2' ' B' ' 421' ' ' PHE . 0.0 OUTLIER -68.91 113.43 6.32 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 117.868 0.834 . . . . 6.25 111.807 -179.291 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 419' ' ' ALA . . . . . 0.458 ' HA ' ' HB3' ' B' ' 422' ' ' ALA . . . -73.29 -20.61 60.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.942 -1.026 . . . . 4.12 112.274 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 420' ' ' GLU . . . . . 0.638 ' HB3' HD12 ' A' ' 73' ' ' LEU . 53.2 mm-40 -61.93 -55.63 27.53 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.36 0.6 . . . . 6.99 110.041 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 421' ' ' PHE . . . . . 0.799 ' HB2' HD21 ' B' ' 418' ' ' ASN . 11.2 m-85 -75.13 -24.56 58.01 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.679 -0.692 . . . . 7.48 110.4 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 422' ' ' ALA . . . . . 0.462 ' O ' ' HG ' ' B' ' 426' ' ' LEU . . . -61.61 -46.69 88.74 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.003 -0.739 . . . . 3.68 109.003 178.645 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 423' ' ' ALA . . . . . 0.485 ' HB1' HG13 ' A' ' 70' ' ' VAL . . . -64.47 -38.84 92.43 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.85 -0.613 . . . . 3.8 109.693 179.03 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 49.1 m -66.98 -31.3 71.77 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.049 -0.523 . . . . 5.05 110.781 178.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 425' ' ' LEU . . . . . 0.548 ' O ' ' HG2' ' B' ' 428' ' ' GLN . 0.4 OUTLIER -81.65 -49.41 10.52 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.773 0.657 . . . . 4.36 112.773 -179.507 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 426' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' B' ' 422' ' ' ALA . 4.2 pp -64.88 -33.82 76.92 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 114.599 1.333 . . . . 3.21 114.599 -177.687 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 427' ' ' PHE . . . . . 0.501 ' CE1' HG12 ' A' ' 44' ' ' ILE . 62.5 t80 -76.34 0.74 18.36 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 113.174 0.805 . . . . 5.27 113.174 -178.322 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 428' ' ' GLN . . . . . 0.548 ' HG2' ' O ' ' B' ' 425' ' ' LEU . 15.6 pt20 -50.93 -46.05 60.73 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.956 0.724 . . . . 5.32 112.956 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 9.5 m . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.549 -0.739 . . . . 5.11 110.361 -179.951 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 ptt? . . . . . 0 N--CA 1.481 1.09 0 CA-C-O 120.623 0.249 . . . . 1.65 110.365 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -105.93 135.18 47.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.864 0.364 . . . . 1.92 111.753 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.1 pt -129.75 165.22 30.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 109.316 -0.624 . . . . 1.48 109.316 178.421 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.454 ' O ' ' HA ' ' A' ' 66' ' ' THR . 87.6 m-85 -122.54 127.5 49.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.646 0.26 . . . . 2.17 110.622 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.472 ' HB ' ' HB ' ' A' ' 13' ' ' ILE . 44.3 t -110.17 124.84 67.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 116.504 -0.317 . . . . 1.65 110.331 179.593 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.402 ' HE3' HG21 ' A' ' 66' ' ' THR . 75.0 mttt -91.71 149.63 21.52 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.417 -0.356 . . . . 3.16 110.625 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.3 p -126.1 167.84 14.82 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.988 -0.551 . . . . 2.17 109.605 179.533 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 33.0 mt -65.22 -23.3 67.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.067 0.461 . . . . 3.05 110.454 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.4 -5.53 56.63 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.572 -0.74 . . . . 2.7 111.124 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.18 30.12 57.59 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 121.051 -0.595 . . . . 2.64 112.523 179.678 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -104.42 129.77 52.36 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 122.774 -0.251 . . . . 2.34 110.574 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.2 m -87.85 112.01 22.02 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.316 -0.402 . . . . 2.31 110.388 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.472 ' HB ' ' HB ' ' A' ' 5' ' ' VAL . 49.0 mt -96.59 116.07 37.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.402 -0.363 . . . . 1.83 110.6 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.58 126.93 32.85 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.717 -0.845 . . . . 2.02 108.717 178.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.511 HD11 HG12 ' A' ' 30' ' ' ILE . 11.5 mt -126.96 139.2 53.21 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.988 0.736 . . . . 1.33 112.988 -178.751 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -95.13 106.74 18.77 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 114.855 -1.066 . . . . 2.4 108.716 178.56 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 6.4 m -140.61 171.05 13.59 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-O 120.87 0.366 . . . . 1.25 110.777 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -124.34 153.35 68.9 Favored Pre-proline 0 C--N 1.319 -0.721 0 N-CA-C 108.903 -0.777 . . . . 1.85 108.903 178.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_exo -53.49 -35.87 77.77 Favored 'Trans proline' 0 CA--C 1.53 0.305 0 C-N-CA 122.45 2.1 . . . . 1.78 112.177 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.1 m -85.02 14.56 4.82 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.54 0.571 . . . . 1.8 112.54 -179.306 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -92.61 135.69 33.86 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.213 -0.662 . . . . 1.23 109.213 178.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.45 147.79 37.68 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.269 -0.423 . . . . 1.44 111.272 -178.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.565 ' HB ' ' HA ' ' A' ' 52' ' ' ASP . 47.3 mm -56.35 -37.41 50.62 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 CA-C-N 116.48 -0.327 . . . . 0.99 110.661 179.701 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.493 ' HB2' ' HB3' ' A' ' 52' ' ' ASP . 28.4 tt0 -57.76 -40.5 79.92 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.244 -0.435 . . . . 2.22 110.673 179.257 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -69.34 -35.13 75.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.023 -0.535 . . . . 1.23 109.839 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.459 ' O ' HG13 ' A' ' 30' ' ' ILE . 59.7 t -65.54 -41.72 91.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 109.133 -0.692 . . . . 0.64 109.133 178.592 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.545 ' HE3' ' HB2' ' A' ' 41' ' ' GLN . 2.4 mmmm -60.98 -40.37 93.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.737 -0.665 . . . . 1.32 109.713 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.47 -36.26 82.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.82 -0.627 . . . . 1.08 110.173 179.127 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -65.74 -35.82 81.82 Favored 'General case' 0 C--N 1.334 -0.082 0 CA-C-N 116.132 -0.485 . . . . 1.08 110.112 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.511 HG12 HD11 ' A' ' 15' ' ' LEU . 79.5 mt -69.79 -38.31 75.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 108.801 -0.814 . . . . 1.31 108.801 178.264 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -63.95 -30.4 71.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.529 -0.759 . . . . 1.93 110.473 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -70.41 -17.25 63.01 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.005 -0.543 . . . . 2.05 110.824 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -107.6 -54.34 2.5 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.105 -0.498 . . . . 2.17 112.014 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -79.12 -36.19 41.02 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 111.916 0.339 . . . . 2.14 111.916 -178.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 94.87 -15.65 62.95 Favored Glycine 0 C--O 1.229 -0.189 0 C-N-CA 120.836 -0.697 . . . . 2.01 112.03 -179.46 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ILE . . . . . 0.402 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 54.2 mt -69.56 126.61 92.7 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 115.905 -0.148 . . . . 1.83 110.746 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.425 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 45.5 Cg_exo -58.68 145.87 94.07 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.124 2.549 . . . . 2.04 112.235 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 37' ' ' PRO . 37.1 Cg_exo -60.05 -21.51 65.6 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.263 2.642 . . . . 1.52 112.638 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.55 -19.76 65.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.265 -0.425 . . . . 2.95 111.735 -179.633 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -114.01 9.06 17.29 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.086 0.469 . . . . 2.56 110.249 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.545 ' HB2' ' HE3' ' A' ' 27' ' ' LYS . 67.5 mt-30 -98.85 108.84 21.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.622 -0.717 . . . . 1.4 110.925 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.557 ' HB3' ' CD2' ' B' ' 427' ' ' PHE . 11.1 mmt85 -104.8 104.43 14.21 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.019 0.438 . . . . 2.65 109.866 178.524 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.637 ' HB3' HD12 ' A' ' 50' ' ' LEU . 9.9 mt -102.15 134.65 45.06 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.741 -0.663 . . . . 1.02 111.699 -178.835 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.801 HG22 ' HA ' ' A' ' 49' ' ' GLN . 10.8 pt -138.73 160.97 30.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.989 -0.55 . . . . 2.14 110.185 178.635 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.495 ' HB2' HD21 ' A' ' 50' ' ' LEU . 53.6 t80 -134.91 106.24 6.77 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.423 -0.584 . . . . 1.71 109.423 179.051 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.92 33.42 19.87 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.086 -0.506 . . . . 2.1 111.725 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 99.95 -31.48 8.38 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.888 -0.673 . . . . 1.84 113.408 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -78.42 130.27 35.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.849 0.324 . . . . 3.05 111.404 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.801 ' HA ' HG22 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -67.77 140.94 56.68 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.914 -0.585 . . . . 2.3 110.529 179.851 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.637 HD12 ' HB3' ' A' ' 43' ' ' LEU . 72.0 mt -97.58 113.01 24.65 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.57 -0.286 . . . . 1.17 110.798 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.621 ' HB2' ' HG2' ' A' ' 54' ' ' ARG . 17.7 mt-10 -76.87 133.06 39.41 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.282 -0.417 . . . . 2.65 109.978 179.001 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.565 ' HA ' ' HB ' ' A' ' 23' ' ' ILE . 4.1 m-20 -58.94 -29.13 66.9 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.919 -0.582 . . . . 1.83 112.209 -179.198 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.53 2.16 83.36 Favored Glycine 0 CA--C 1.52 0.354 0 C-N-CA 121.055 -0.593 . . . . 1.82 113.719 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.621 ' HG2' ' HB2' ' A' ' 51' ' ' GLU . 15.7 mmt180 -107.99 166.12 10.96 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.073 0.437 . . . . 2.69 110.328 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 76.9 p -105.04 177.39 4.86 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.782 -0.451 . . . . 1.71 109.782 179.421 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.458 ' HB3' ' HB ' ' A' ' 61' ' ' ILE . 94.8 mt -67.19 -34.87 78.42 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.971 0.415 . . . . 1.49 109.882 179.071 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -27.47 68.93 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.958 -0.565 . . . . 1.94 111.368 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -65.23 -23.34 67.04 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.908 0.385 . . . . 2.03 111.704 -179.319 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -115.03 16.07 17.13 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.386 -0.37 . . . . 1.76 110.929 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 59.66 29.09 18.64 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.769 -0.651 . . . . 2.96 111.658 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.458 ' HB ' ' HB3' ' A' ' 56' ' ' LEU . 76.7 mt -77.48 119.61 26.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.044 -0.526 . . . . 1.65 110.335 -179.798 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 15.0 mt-30 -110.96 -167.99 1.25 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.67 -0.695 . . . . 2.66 109.496 -179.74 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 24.0 pttt -73.3 152.73 40.84 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 121.01 -0.276 . . . . 3.22 110.412 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 70.4 -1.53 2.48 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.574 0.583 . . . . 3.12 112.574 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 69.1 m -69.88 137.19 51.45 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 110.235 -0.283 . . . . 1.83 110.235 179.498 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.454 ' HA ' ' O ' ' A' ' 4' ' ' PHE . 3.4 m -96.57 120.41 36.84 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.168 0.509 . . . . 2.03 111.713 -179.202 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.7 mp -98.73 156.43 16.84 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.551 -0.907 . . . . 1.41 108.551 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.435 ' HB2' HG13 ' A' ' 44' ' ' ILE . 72.7 m80 -117.03 125.44 51.35 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.862 0.363 . . . . 2.76 111.937 -179.124 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.473 HD13 ' HG ' ' A' ' 43' ' ' LEU . 47.5 tp -115.58 120.36 39.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.921 -0.582 . . . . 1.54 110.521 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.2 t -112.74 138.89 40.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.005 -0.543 . . . . 1.79 110.678 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.8 mt -72.05 122.82 21.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.84 -0.618 . . . . 2.43 110.343 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 59.3 ttt180 -89.92 104.5 17.06 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.29 -0.414 . . . . 3.19 110.553 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.4 mp -69.29 113.35 6.55 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.909 -0.587 . . . . 2.99 110.546 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.4 ' HD2' HH11 ' A' ' 74' ' ' ARG . 8.6 mmt85 . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 116.05 -0.523 . . . . 3.67 110.317 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 390' ' ' PHE . . . . . 0.613 ' HB2' HD11 ' B' ' 395' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.257 0 CA-C-O 120.605 0.24 . . . . 2.51 110.423 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 391' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' B' ' 390' ' ' PHE . 10.5 Cg_exo -71.42 136.27 28.33 Favored 'Trans proline' 0 C--O 1.237 0.434 0 C-N-CA 122.792 2.328 . . . . 3.77 111.44 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.75 -36.14 69.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.231 -0.441 . . . . 5.36 112.066 -179.212 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -56.79 -52.89 63.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.045 0.45 . . . . 6.89 110.9 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -67.47 -36.24 80.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.886 -0.597 . . . . 4.2 110.948 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 395' ' ' ILE . . . . . 0.613 ' O ' ' HG2' ' B' ' 399' ' ' MET . 74.1 mt -59.59 -52.28 62.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.058 -0.519 . . . . 3.8 110.224 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 31.8 mttp -56.29 -42.7 77.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.355 -0.384 . . . . 6.27 111.445 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -61.95 -39.01 90.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.276 -0.42 . . . . 6.91 111.23 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 398' ' ' LEU . . . . . 0.413 HD12 HG23 ' B' ' 408' ' ' VAL . 90.4 mt -76.71 -31.67 57.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.401 -0.363 . . . . 4.31 111.316 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 399' ' ' MET . . . . . 0.613 ' HG2' ' O ' ' B' ' 395' ' ' ILE . 35.0 mmt -66.97 -39.96 87.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.075 0.464 . . . . 5.8 110.0 179.388 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -62.38 -28.26 69.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.572 -0.74 . . . . 7.71 111.975 -179.535 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 401' ' ' LEU . . . . . 0.769 ' HB3' HD11 ' A' ' 44' ' ' ILE . 38.2 mt -63.69 -26.83 68.84 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.071 0.462 . . . . 5.69 110.59 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 111.61 27.1 4.23 Favored Glycine 0 N--CA 1.446 -0.638 0 N-CA-C 111.483 -0.647 . . . . 5.87 111.483 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 403' ' ' PHE . . . . . 0.569 ' HE2' HD13 ' A' ' 44' ' ' ILE . 33.4 m-85 -113.08 143.21 28.72 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-O 120.652 0.263 . . . . 4.83 110.91 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.88 164.62 31.45 Favored 'Trans proline' 0 C--O 1.236 0.418 0 C-N-CA 123.022 2.481 . . . . 4.72 112.949 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 405' ' ' ARG . . . . . 0.501 ' HA ' HG12 ' B' ' 408' ' ' VAL . 91.0 mtt180 -64.12 -28.26 69.65 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.796 -0.638 . . . . 4.16 111.408 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -63.32 -37.71 88.33 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.011 0.434 . . . . 4.69 110.448 179.19 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -68.56 -45.19 72.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.8 -0.637 . . . . 2.99 111.453 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 408' ' ' VAL . . . . . 0.501 HG12 ' HA ' ' B' ' 405' ' ' ARG . 14.6 p -63.22 -41.23 92.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 N-CA-C 112.091 0.404 . . . . 2.06 112.091 -179.313 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 74.7 t -64.23 -50.23 77.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.902 0.382 . . . . 2.89 111.143 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -62.85 -40.52 97.69 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.295 -0.411 . . . . 5.05 111.706 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -67.89 -45.43 74.47 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.296 -0.411 . . . . 2.96 110.979 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 412' ' ' LEU . . . . . 0.449 HD13 ' HA2' ' B' ' 417' ' ' GLY . 0.8 OUTLIER -61.26 -33.72 74.0 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.198 -0.456 . . . . 3.45 111.543 -179.671 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 42.3 mmtt -69.76 -50.81 39.67 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.121 0.415 . . . . 5.52 112.121 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -70.29 -23.83 62.93 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 113.17 0.804 . . . . 5.53 113.17 -178.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 415' ' ' THR . . . . . 0.475 HG21 ' HA ' ' B' ' 422' ' ' ALA . 68.6 p -99.01 -5.02 31.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.005 0.431 . . . . 5.42 110.973 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 57.76 61.72 2.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.494 -0.775 . . . . 6.37 112.96 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 417' ' ' GLY . . . . . 0.449 ' HA2' HD13 ' B' ' 412' ' ' LEU . . . 76.92 -14.46 7.46 Favored Glycine 0 CA--C 1.519 0.314 0 N-CA-C 114.902 0.721 . . . . 4.33 114.902 177.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -71.32 94.16 1.19 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 117.733 0.767 . . . . 6.25 110.166 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -61.79 -33.34 73.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.089 -0.505 . . . . 4.12 111.853 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -65.91 -43.43 88.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.238 0.542 . . . . 6.99 109.628 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.53 -36.99 65.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.701 -0.681 . . . . 7.48 109.6 179.211 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 422' ' ' ALA . . . . . 0.475 ' HA ' HG21 ' B' ' 415' ' ' THR . . . -59.28 -47.02 86.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.834 -0.621 . . . . 3.68 110.529 179.321 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -60.23 -46.31 90.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.154 -0.475 . . . . 3.8 110.436 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 61.3 m -65.38 -29.18 69.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.201 -0.454 . . . . 5.05 111.519 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -80.69 -49.71 10.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.416 -0.356 . . . . 4.36 111.947 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 4.2 pp -64.09 -33.03 74.84 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.927 0.343 . . . . 3.21 111.927 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 427' ' ' PHE . . . . . 0.557 ' CD2' ' HB3' ' A' ' 42' ' ' ARG . 2.0 m-85 -63.07 -11.03 16.79 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.772 0.656 . . . . 5.27 112.772 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -67.05 -20.55 65.86 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.764 0.316 . . . . 5.32 110.943 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 1.6 m . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.775 -0.631 . . . . 5.11 110.741 179.984 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.483 ' HB2' ' HB3' ' A' ' 63' ' ' LYS . 22.7 ptt? . . . . . 0 N--CA 1.484 1.251 0 N-CA-C 110.463 -0.199 . . . . 1.65 110.463 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 55.0 mm-40 -109.4 143.06 39.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.468 0.175 . . . . 1.92 110.764 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 25.0 pt -128.7 162.83 34.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.473 -0.331 . . . . 1.48 110.535 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -118.34 112.23 19.77 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.429 -0.35 . . . . 2.17 110.921 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.82 ' HB ' ' HB ' ' A' ' 13' ' ' ILE . 25.1 t -98.86 114.58 37.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.298 -0.41 . . . . 1.65 110.602 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -86.91 125.91 34.34 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.29 -0.414 . . . . 3.16 111.132 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.17 162.15 13.49 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.045 -0.525 . . . . 2.17 109.797 179.376 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 85.5 mt -64.56 -11.03 30.3 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 112.235 0.457 . . . . 3.05 112.235 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.25 11.94 34.68 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.217 -0.447 . . . . 2.7 111.077 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.16 28.27 70.47 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 121.195 -0.526 . . . . 2.64 112.641 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -101.26 143.84 30.84 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 110.511 -0.181 . . . . 2.34 110.511 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.6 m -107.46 105.04 14.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.055 0.455 . . . . 2.31 110.858 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.82 ' HB ' ' HB ' ' A' ' 5' ' ' VAL . 70.9 mt -86.1 114.44 25.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.86 -0.609 . . . . 1.83 109.891 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.7 m -96.33 113.69 25.3 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.739 -0.467 . . . . 2.02 109.739 179.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.445 ' HG ' HG22 ' A' ' 13' ' ' ILE . 56.6 mt -122.64 156.63 33.92 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.97 0.414 . . . . 1.33 111.732 -179.195 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -101.01 119.36 38.63 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.458 -0.792 . . . . 2.4 109.685 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.418 ' O ' ' HG2' ' A' ' 1' ' ' MET . 13.2 m -142.22 -171.86 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 116.101 -0.5 . . . . 1.25 110.042 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.407 ' O ' HD12 ' A' ' 56' ' ' LEU . 25.5 mm-40 -152.55 156.32 33.26 Favored Pre-proline 0 C--N 1.322 -0.604 0 N-CA-C 107.903 -1.147 . . . . 1.85 107.903 179.002 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.47 ' HA ' ' HB2' ' A' ' 56' ' ' LEU . 73.4 Cg_exo -51.89 -35.16 58.79 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 122.422 2.081 . . . . 1.78 112.003 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.8 m -75.06 8.33 2.65 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.931 0.715 . . . . 1.8 112.931 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -92.41 147.96 22.49 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 122.187 -0.321 . . . . 1.23 110.451 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.8 OUTLIER -93.96 152.04 19.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.317 -0.401 . . . . 1.44 110.652 -179.515 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.433 ' HB ' ' HA ' ' A' ' 52' ' ' ASP . 49.8 mm -58.05 -43.17 84.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.398 -0.364 . . . . 0.99 110.411 179.642 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.619 ' HG3' ' HB3' ' A' ' 52' ' ' ASP . 37.7 mt-10 -57.88 -37.59 74.24 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.107 -0.497 . . . . 2.22 110.861 179.051 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.485 ' O ' ' HG3' ' A' ' 29' ' ' LYS . 56.2 t30 -72.67 -37.26 67.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.34 -0.391 . . . . 1.23 110.594 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 92.7 t -63.51 -46.95 93.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.199 -0.455 . . . . 0.64 110.016 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.4 mtmt -64.51 -31.87 73.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.11 -0.496 . . . . 1.32 110.72 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.62 -36.61 83.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.165 -0.47 . . . . 1.08 110.082 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 69.1 mttt -68.7 -40.34 80.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.986 -0.552 . . . . 1.08 109.744 179.216 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 50.3 mt -66.67 -38.96 82.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.991 -0.55 . . . . 1.31 109.586 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.29 -36.53 80.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.396 -0.82 . . . . 1.93 111.922 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -72.2 -38.77 68.98 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.811 0.671 . . . . 2.05 112.811 -178.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -87.03 -43.93 11.96 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 113.208 0.818 . . . . 2.17 113.208 -178.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -82.67 -22.2 34.68 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.707 0.632 . . . . 2.14 112.707 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 73.92 26.36 69.22 Favored Glycine 0 CA--C 1.517 0.197 0 C-N-CA 120.694 -0.765 . . . . 2.01 112.279 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 80.2 mt -108.12 128.28 26.03 Favored Pre-proline 0 C--N 1.326 -0.449 0 N-CA-C 110.106 -0.331 . . . . 1.83 110.106 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -55.21 132.78 54.31 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.908 2.405 . . . . 2.04 111.999 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -57.91 -22.59 55.14 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 123.031 2.487 . . . . 1.52 112.92 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.62 -29.56 67.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.766 0.317 . . . . 2.95 111.412 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -94.16 -3.79 50.3 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.288 -0.414 . . . . 2.56 110.534 -179.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -86.48 107.89 18.28 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.959 -0.564 . . . . 1.4 111.5 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.461 ' HB3' ' CE2' ' B' ' 427' ' ' PHE . 12.0 mmt85 -109.76 109.01 19.57 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.221 -0.659 . . . . 2.65 109.221 178.467 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.48 ' HB3' HD12 ' A' ' 50' ' ' LEU . 30.9 mt -87.07 136.61 32.86 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.016 0.436 . . . . 1.02 112.159 -179.073 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.723 HD11 HG23 ' A' ' 70' ' ' VAL . 1.1 mt -122.41 145.09 29.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.688 -0.687 . . . . 2.14 110.298 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.441 ' CB ' HD21 ' A' ' 50' ' ' LEU . 46.2 t80 -133.92 97.33 3.86 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.952 -0.567 . . . . 1.71 109.507 178.449 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 61.35 40.98 13.6 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.764 -0.653 . . . . 2.1 111.99 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.12 -5.94 84.17 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 120.949 -0.643 . . . . 1.84 113.775 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -103.36 136.27 43.42 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.858 0.329 . . . . 3.05 110.545 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.452 ' OE1' ' HD2' ' A' ' 42' ' ' ARG . 5.9 tt0 -78.61 136.42 37.5 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.618 0.247 . . . . 2.3 110.408 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.48 HD12 ' HB3' ' A' ' 43' ' ' LEU . 71.4 mt -93.88 137.25 33.31 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.916 0.389 . . . . 1.17 111.383 -179.599 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.598 ' HB2' ' HG2' ' A' ' 54' ' ' ARG . 3.3 mt-10 -87.9 132.21 34.29 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.116 -0.493 . . . . 2.65 109.731 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.619 ' HB3' ' HG3' ' A' ' 24' ' ' GLU . 4.1 m-20 -59.37 -32.07 69.79 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 112.906 0.706 . . . . 1.83 112.906 -179.106 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -87.71 33.12 4.03 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.762 -0.732 . . . . 1.82 113.697 -179.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.598 ' HG2' ' HB2' ' A' ' 51' ' ' GLU . 24.4 mmt180 -131.46 171.33 13.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.809 0.337 . . . . 2.69 110.339 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 22' ' ' THR . 67.6 p -109.09 168.61 9.24 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.285 -0.635 . . . . 1.71 109.285 179.091 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.47 ' HB2' ' HA ' ' A' ' 19' ' ' PRO . 65.8 mt -66.88 -29.23 69.08 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.98 0.419 . . . . 1.49 110.139 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.78 -25.87 65.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.959 -0.564 . . . . 1.94 111.226 179.303 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -62.99 -26.76 69.01 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.39 -0.368 . . . . 2.03 111.658 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.463 ' HB2' HG13 ' A' ' 61' ' ' ILE . 70.7 m-85 -112.7 9.03 19.17 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.26 -0.427 . . . . 1.76 109.999 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 58.24 39.39 25.77 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.436 -0.802 . . . . 2.96 111.314 -179.186 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.463 HG13 ' HB2' ' A' ' 59' ' ' TYR . 78.0 mt -76.0 109.94 10.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.807 -0.633 . . . . 1.65 110.046 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -99.0 -172.42 2.28 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.85 -0.614 . . . . 2.66 111.186 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.483 ' HB3' ' HB2' ' A' ' 1' ' ' MET . 52.8 pttt -68.6 151.01 47.32 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.246 -0.434 . . . . 3.22 112.077 -179.554 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 65.54 22.08 11.78 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.367 -0.833 . . . . 3.12 112.98 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.3 m -87.83 145.7 25.95 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.741 0.305 . . . . 1.83 110.299 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.2 m -95.36 128.51 42.27 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.145 -0.479 . . . . 2.03 111.597 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . 0.425 ' O ' ' HA ' ' A' ' 5' ' ' VAL . 6.8 mp -119.48 143.59 47.45 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.422 -0.955 . . . . 1.41 108.422 178.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.614 ' HB2' ' HB ' ' A' ' 44' ' ' ILE . 46.9 m80 -105.33 149.22 26.25 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 120.534 0.207 . . . . 2.76 110.729 -179.089 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 54.8 tp -126.76 111.09 13.83 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.064 0.459 . . . . 1.54 111.512 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.723 HG23 HD11 ' A' ' 44' ' ' ILE . 4.5 t -101.09 129.4 52.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.978 -0.555 . . . . 1.79 110.076 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.8 mt -86.18 97.14 10.18 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.063 -0.517 . . . . 2.43 109.649 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.41 ' HA ' ' OG ' ' B' ' 424' ' ' SER . 55.3 ttt-85 -89.62 106.28 18.35 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.098 0.475 . . . . 3.19 111.17 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 57.1 mt -84.75 -169.22 2.53 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.738 -0.664 . . . . 2.99 110.207 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 74' ' ' ARG . 17.1 mmt180 -120.33 102.35 8.42 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 110.012 -0.366 . . . . 3.67 110.012 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 132.83 -149.78 19.62 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.788 -0.72 . . . . 3.08 112.291 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.086 0 CA-C-O 118.941 -0.921 . . . . 3.82 111.602 -179.813 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.567 0 N-CA-C 111.859 -0.496 . . . . 5.66 111.859 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 1.6 m -83.59 53.94 2.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.185 0.517 . . . . 5.53 110.885 -179.54 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -87.27 76.1 9.21 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.079 -0.51 . . . . 3.98 110.764 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.97 -13.99 60.58 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.001 -0.545 . . . . 4.15 111.12 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 390' ' ' PHE . . . . . 0.508 ' HB2' HD11 ' B' ' 395' ' ' ILE . 2.1 m-85 -106.61 107.37 60.05 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 2.51 110.095 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 391' ' ' PRO . . . . . 0.464 ' O ' HG13 ' B' ' 395' ' ' ILE . 21.2 Cg_exo -66.14 125.74 14.6 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.894 2.396 . . . . 3.77 111.419 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 392' ' ' GLU . . . . . 0.514 ' HG2' ' HE3' ' B' ' 396' ' ' LYS . 40.5 tt0 -52.68 -49.39 65.37 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 112.499 0.555 . . . . 5.36 112.499 -178.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -53.55 -52.87 58.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 6.89 111.655 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 394' ' ' THR . . . . . 0.405 ' OG1' ' HB2' ' B' ' 391' ' ' PRO . 0.3 OUTLIER -66.08 -36.55 83.48 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.622 0.601 . . . . 4.2 112.622 -178.652 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 395' ' ' ILE . . . . . 0.508 HD11 ' HB2' ' B' ' 390' ' ' PHE . 89.1 mt -58.3 -48.84 83.83 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 N-CA-C 109.585 -0.524 . . . . 3.8 109.585 178.814 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 396' ' ' LYS . . . . . 0.514 ' HE3' ' HG2' ' B' ' 392' ' ' GLU . 95.3 mttt -62.98 -40.14 96.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.603 -0.726 . . . . 6.27 110.641 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 397' ' ' GLN . . . . . 0.492 ' O ' ' HG ' ' B' ' 401' ' ' LEU . 12.3 mm-40 -62.5 -47.7 82.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.16 -0.473 . . . . 6.91 110.983 179.321 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 398' ' ' LEU . . . . . 0.464 HD11 ' HB1' ' B' ' 419' ' ' ALA . 95.4 mt -64.8 -41.97 95.4 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.354 -0.384 . . . . 4.31 111.548 -179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 57.7 mtp -69.55 -31.6 69.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.895 0.379 . . . . 5.8 111.406 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -66.01 -18.84 65.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.943 -0.571 . . . . 7.71 111.381 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 401' ' ' LEU . . . . . 0.601 ' HA ' ' CD2' ' A' ' 68' ' ' HIS . 16.8 mt -78.51 2.28 19.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.971 -0.559 . . . . 5.69 110.933 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 93.2 41.12 4.65 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.927 -0.654 . . . . 5.87 111.844 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 403' ' ' PHE . . . . . 0.462 ' HE2' HD13 ' A' ' 44' ' ' ILE . 74.4 m-85 -132.1 146.18 60.57 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 120.524 0.202 . . . . 4.83 110.462 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -79.43 164.2 24.04 Favored 'Trans proline' 0 C--O 1.234 0.276 0 C-N-CA 122.479 2.119 . . . . 4.72 111.638 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' B' ' 405' ' ' ARG . 14.5 ttt85 -64.91 -29.21 70.14 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.337 -0.392 . . . . 4.16 110.809 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -58.51 -44.12 89.38 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.819 -0.628 . . . . 4.69 110.978 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -66.34 -38.48 87.74 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.656 -0.702 . . . . 2.99 110.476 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 67.9 t -64.01 -50.98 74.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.636 -0.711 . . . . 2.06 110.985 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 86.2 t -56.99 -51.1 73.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 112.219 0.451 . . . . 2.89 112.219 -179.144 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 78.9 mttt -64.68 -44.68 89.57 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 112.254 0.465 . . . . 5.05 112.254 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -65.09 -38.43 90.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.841 0.353 . . . . 2.96 110.587 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.71 -35.99 73.01 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.059 -0.519 . . . . 3.45 110.476 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? -60.23 -38.16 82.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.062 -0.517 . . . . 5.52 111.674 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -87.4 -7.43 57.72 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.962 0.727 . . . . 5.53 112.962 -179.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 16.2 p -108.46 -30.56 8.22 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.214 0.45 . . . . 5.42 112.214 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 70.09 63.56 0.23 Allowed 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 114.123 1.157 . . . . 6.37 114.123 179.025 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 89.67 -26.78 8.79 Favored Glycine 0 C--N 1.32 -0.313 0 N-CA-C 115.569 0.988 . . . . 4.33 115.569 176.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 418' ' ' ASN . . . . . 0.455 ' HB2' ' HD2' ' B' ' 421' ' ' PHE . 0.0 OUTLIER -80.05 80.3 6.48 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 118.197 0.998 . . . . 6.25 110.361 179.476 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 419' ' ' ALA . . . . . 0.464 ' HB1' HD11 ' B' ' 398' ' ' LEU . . . -59.78 -27.05 66.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.98 -1.009 . . . . 4.12 112.125 -178.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -62.46 -41.73 98.97 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.238 -1.023 . . . . 6.99 108.238 178.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 421' ' ' PHE . . . . . 0.455 ' HD2' ' HB2' ' B' ' 418' ' ' ASN . 44.7 m-85 -76.98 -30.69 56.07 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.243 -0.89 . . . . 7.48 109.319 178.683 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 422' ' ' ALA . . . . . 0.437 ' HB3' ' HA ' ' B' ' 419' ' ' ALA . . . -62.95 -43.81 97.78 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.935 -0.575 . . . . 3.68 109.715 178.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.464 ' HA ' ' HG ' ' B' ' 426' ' ' LEU . . . -63.89 -39.23 93.7 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.15 -0.685 . . . . 3.8 109.15 178.705 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 424' ' ' SER . . . . . 0.41 ' OG ' ' HA ' ' A' ' 72' ' ' ARG . 50.9 m -62.95 -30.89 71.92 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.623 -0.717 . . . . 5.05 110.373 178.342 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 425' ' ' LEU . . . . . 0.65 ' O ' ' HG2' ' B' ' 428' ' ' GLN . 2.8 mm? -81.18 -49.62 10.58 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 115.808 -0.633 . . . . 4.36 111.77 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 426' ' ' LEU . . . . . 0.464 ' HG ' ' HA ' ' B' ' 423' ' ' ALA . 4.4 pp -64.22 -33.72 76.44 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.728 0.64 . . . . 3.21 112.728 -179.503 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 427' ' ' PHE . . . . . 0.598 ' CZ ' HG12 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -75.86 -1.4 25.11 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 113.878 1.066 . . . . 5.27 113.878 -178.697 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 428' ' ' GLN . . . . . 0.65 ' HG2' ' O ' ' B' ' 425' ' ' LEU . 3.7 pt20 -89.7 11.31 20.27 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.105 0.479 . . . . 5.32 111.258 179.325 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 C--O 1.248 1.025 0 CA-C-N 116.054 -0.521 . . . . 5.11 110.61 179.546 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.587 ' HB2' ' HB3' ' A' ' 63' ' ' LYS . 25.9 ptt? . . . . . 0 N--CA 1.481 1.076 0 CA-C-O 120.618 0.246 . . . . 1.65 110.664 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 75.3 mm-40 -99.28 134.4 42.19 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.763 0.316 . . . . 1.92 110.908 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 23.3 pt -127.53 155.8 38.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.315 -0.402 . . . . 1.48 110.087 178.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -116.9 124.56 49.75 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.404 -0.362 . . . . 2.17 110.454 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.3 t -111.21 123.49 67.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 110.108 -0.33 . . . . 1.65 110.108 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -104.31 139.95 38.56 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.446 -0.343 . . . . 3.16 110.922 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.478 ' OG1' ' HB3' ' A' ' 11' ' ' LYS . 6.4 p -107.26 174.21 5.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.345 -0.388 . . . . 2.17 110.79 179.243 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.585 HD11 ' HB1' ' B' ' 423' ' ' ALA . 1.2 mt -58.81 -33.55 70.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.86 -0.609 . . . . 3.05 112.086 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.91 -3.2 47.08 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.039 0.385 . . . . 2.7 112.039 -179.118 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.91 8.17 69.75 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.755 -0.736 . . . . 2.64 112.252 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.478 ' HB3' ' OG1' ' A' ' 7' ' ' THR . 77.4 tttt -79.66 121.96 25.94 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.72 -0.474 . . . . 2.34 109.72 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.8 m -103.65 128.12 51.01 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.917 0.389 . . . . 2.31 111.185 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 18.4 mt -115.17 143.41 25.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 109.685 -0.487 . . . . 1.83 109.685 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.5 m -111.96 125.6 54.24 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.652 0.263 . . . . 2.02 110.306 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.8 mp -127.01 142.57 51.52 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.277 -0.419 . . . . 1.33 110.916 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -99.19 106.2 18.33 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 116.078 -0.51 . . . . 2.4 109.967 179.079 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.427 ' O ' ' HG2' ' A' ' 1' ' ' MET . 7.0 m -134.16 164.08 35.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 109.307 -0.627 . . . . 1.25 109.307 179.804 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.481 ' HA ' ' OE1' ' A' ' 18' ' ' GLU . 5.9 mm-40 -104.92 155.34 37.72 Favored Pre-proline 0 C--N 1.32 -0.689 0 C-N-CA 121.106 -0.238 . . . . 1.85 110.439 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_exo -58.12 -17.43 31.76 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.991 2.461 . . . . 1.78 113.008 -179.372 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.1 -1.75 58.24 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.514 -0.312 . . . . 1.8 111.804 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -79.32 142.56 35.98 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.902 0.382 . . . . 1.23 111.032 -179.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.6 m -81.59 146.79 29.93 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.784 -0.644 . . . . 1.44 110.269 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.406 HG12 ' O ' ' A' ' 54' ' ' ARG . 43.0 mm -53.07 -44.97 52.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 O-C-N 123.202 0.314 . . . . 0.99 111.585 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -58.35 -41.22 84.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.481 -0.327 . . . . 2.22 111.527 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -63.45 -36.42 83.7 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.992 0.425 . . . . 1.23 110.383 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.402 ' O ' HG13 ' A' ' 30' ' ' ILE . 58.1 t -67.1 -42.61 88.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.989 -0.55 . . . . 0.64 109.572 178.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 27.3 mtmt -63.31 -37.38 87.04 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.207 -0.451 . . . . 1.32 110.37 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.86 -37.38 84.31 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.097 -0.501 . . . . 1.08 109.844 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -68.49 -34.21 75.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.793 -0.639 . . . . 1.08 110.143 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.402 HG13 ' O ' ' A' ' 26' ' ' VAL . 70.9 mt -70.63 -32.85 50.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 108.97 -0.752 . . . . 1.31 108.97 178.59 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -66.31 -32.89 74.57 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.484 -0.78 . . . . 1.93 109.383 178.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -71.79 -42.92 66.52 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.456 -0.793 . . . . 2.05 109.705 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -66.82 -59.66 3.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.675 -0.693 . . . . 2.17 112.186 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -92.0 -65.27 1.02 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.197 -0.456 . . . . 2.14 112.179 -178.344 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 133.54 0.72 4.0 Favored Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.323 -0.941 . . . . 2.01 112.652 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 16.7 mt -67.83 125.1 90.91 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 110.144 -0.317 . . . . 1.83 110.144 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.423 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 52.4 Cg_exo -54.84 135.89 69.77 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.73 2.286 . . . . 2.04 111.423 179.6 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 37' ' ' PRO . 75.6 Cg_exo -51.54 -30.58 36.29 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 123.271 2.647 . . . . 1.52 113.438 -179.541 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -70.16 -29.69 66.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.162 0.506 . . . . 2.95 111.584 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -89.0 -4.46 58.42 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.342 -0.39 . . . . 2.56 110.289 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -92.85 111.82 23.56 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.797 -0.638 . . . . 1.4 111.173 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.497 ' HB3' ' CZ ' ' B' ' 427' ' ' PHE . 0.9 OUTLIER -125.07 104.3 8.47 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 108.618 -0.882 . . . . 2.65 108.618 178.713 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.471 ' HB3' HD12 ' A' ' 50' ' ' LEU . 82.8 mt -81.99 138.09 34.98 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.9 0.704 . . . . 1.02 112.9 -178.088 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 65.8 mt -124.09 134.96 65.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.265 -0.88 . . . . 2.14 109.732 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.47 ' HE1' ' HB3' ' A' ' 65' ' ' SER . 57.3 t80 -124.19 107.16 10.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.446 -0.343 . . . . 1.71 110.274 179.239 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.33 35.1 23.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.882 -0.599 . . . . 2.1 112.108 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.562 ' HA2' ' HA3' ' B' ' 402' ' ' GLY . . . 92.71 -13.48 67.38 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 120.909 -0.662 . . . . 1.84 112.924 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.3 mttt -90.44 142.12 28.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.657 0.228 . . . . 3.05 110.807 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.418 HE22 ' HZ ' ' B' ' 427' ' ' PHE . 40.9 tp60 -83.61 135.76 34.49 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 110.025 -0.361 . . . . 2.3 110.025 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.471 HD12 ' HB3' ' A' ' 43' ' ' LEU . 40.7 mt -97.58 135.85 38.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.717 0.294 . . . . 1.17 110.943 -179.634 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.419 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 31.7 tt0 -96.51 138.48 34.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.007 0.432 . . . . 2.65 111.078 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.25 -26.49 66.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.63 -0.713 . . . . 1.83 112.527 -179.584 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.419 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -87.75 11.21 67.2 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.736 -0.745 . . . . 1.82 114.043 -178.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.427 HH11 ' HD3' ' A' ' 54' ' ' ARG . 41.9 mmt-85 -117.79 164.07 15.56 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 117.26 0.53 . . . . 2.69 111.11 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 61.1 p -102.05 171.83 7.27 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.175 -0.466 . . . . 1.71 110.202 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 84.0 mt -63.95 -33.72 76.36 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.105 0.479 . . . . 1.49 110.528 179.051 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 67.4 m -70.03 -23.94 63.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.921 -0.581 . . . . 1.94 111.332 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -67.25 -20.21 65.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.397 -0.365 . . . . 2.03 111.758 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -114.66 12.57 17.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.105 -0.498 . . . . 1.76 110.735 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.0 m-20 58.49 37.86 25.56 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.667 -0.697 . . . . 2.96 111.625 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 86.9 mt -82.76 120.5 34.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.123 -0.49 . . . . 1.65 110.112 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -106.33 -167.69 1.33 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.943 -0.571 . . . . 2.66 109.975 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.587 ' HB3' ' HB2' ' A' ' 1' ' ' MET . 10.0 pttp -76.45 150.79 36.66 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 121.116 -0.233 . . . . 3.22 110.629 179.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 70.99 14.16 6.87 Favored 'General case' 0 C--O 1.235 0.29 0 O-C-N 123.654 0.597 . . . . 3.12 112.155 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.47 ' HB3' ' HE1' ' A' ' 45' ' ' PHE . 35.5 m -79.0 149.66 32.16 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.301 -0.409 . . . . 1.83 109.976 178.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -105.04 124.69 49.97 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.117 -0.492 . . . . 2.03 111.059 -179.24 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.0 mp -110.8 138.5 47.12 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.993 -0.743 . . . . 1.41 108.993 179.136 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 65.3 m80 -103.31 136.96 42.1 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.711 0.291 . . . . 2.76 111.587 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 48.5 tp -123.59 102.3 7.78 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.993 -0.548 . . . . 1.54 109.96 179.477 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.705 ' HB ' ' CE2' ' B' ' 427' ' ' PHE . 16.5 t -92.21 135.65 26.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.041 -0.527 . . . . 1.79 109.792 179.846 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.567 ' H ' HD12 ' A' ' 8' ' ' LEU . 65.6 mt -83.22 124.62 30.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.374 -0.375 . . . . 2.43 111.452 -179.203 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 38.1 ttt180 -118.67 99.11 6.58 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.891 -0.595 . . . . 3.19 110.836 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 89.0 mt -72.42 167.44 20.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.025 -0.534 . . . . 2.99 110.457 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.472 ' HD3' ' HA ' ' A' ' 74' ' ' ARG . 0.3 OUTLIER -103.37 -27.38 12.48 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.859 0.361 . . . . 3.67 111.204 -179.692 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -164.36 179.46 39.15 Favored Glycine 0 N--CA 1.446 -0.679 0 N-CA-C 111.307 -0.717 . . . . 3.08 111.307 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.89 0 CA-C-O 118.82 -0.989 . . . . 3.82 111.712 179.892 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.825 0 N-CA-C 111.904 -0.478 . . . . 5.66 111.904 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.55 81.29 7.69 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.06 0.457 . . . . 5.53 110.928 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -121.51 86.95 2.66 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.052 0.453 . . . . 3.98 110.391 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.2 m -73.69 -16.19 61.21 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.84 -0.618 . . . . 4.15 110.671 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -111.2 102.04 51.89 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-N 116.059 -0.519 . . . . 2.51 109.931 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo -64.91 132.42 32.3 Favored 'Trans proline' 0 C--O 1.236 0.404 0 C-N-CA 122.667 2.244 . . . . 3.77 111.606 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -51.77 -45.26 63.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.734 -0.666 . . . . 5.36 112.678 -178.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -54.5 -48.62 71.66 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.235 0.457 . . . . 6.89 112.235 -179.193 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.54 -39.17 93.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.286 -0.416 . . . . 4.2 110.898 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 395' ' ' ILE . . . . . 0.47 ' O ' ' HG2' ' B' ' 399' ' ' MET . 83.0 mt -62.73 -42.0 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.117 0 CA-C-N 116.19 -0.459 . . . . 3.8 110.197 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -57.18 -43.71 82.9 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.186 -0.461 . . . . 6.27 111.382 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 8.8 tp60 -65.8 -41.6 91.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.021 0.438 . . . . 6.91 110.808 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 92.8 mt -67.74 -34.94 77.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 4.31 111.908 -179.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 399' ' ' MET . . . . . 0.47 ' HG2' ' O ' ' B' ' 395' ' ' ILE . 31.5 mmt -67.27 -33.78 76.04 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.979 0.418 . . . . 5.8 110.172 179.638 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -61.58 -27.2 68.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.527 -0.76 . . . . 7.71 111.697 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 401' ' ' LEU . . . . . 0.42 HD22 HG22 ' A' ' 70' ' ' VAL . 30.9 mt -74.3 -6.45 48.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.12 -0.491 . . . . 5.69 112.155 -179.332 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 402' ' ' GLY . . . . . 0.562 ' HA3' ' HA2' ' A' ' 47' ' ' GLY . . . 85.53 46.36 5.51 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.609 -0.805 . . . . 5.87 112.384 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 403' ' ' PHE . . . . . 0.409 ' HA ' ' HD3' ' B' ' 404' ' ' PRO . 24.6 m-85 -125.64 156.98 70.03 Favored Pre-proline 0 C--N 1.329 -0.285 0 C-N-CA 122.205 0.202 . . . . 4.83 110.577 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 404' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' B' ' 403' ' ' PHE . 2.0 Cg_endo -84.65 146.31 10.63 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.864 2.376 . . . . 4.72 111.084 178.476 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.411 ' HA ' ' HE1' ' B' ' 399' ' ' MET . 37.4 ttt180 -63.58 -32.24 73.64 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.784 0.29 . . . . 4.16 111.784 -179.419 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -57.24 -40.07 76.85 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.154 0.502 . . . . 4.69 110.719 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -69.79 -36.69 75.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.759 -0.655 . . . . 2.99 109.931 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 49.7 t -63.24 -44.11 99.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.655 -0.702 . . . . 2.06 110.272 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 74.1 t -56.52 -49.09 79.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.002 -0.544 . . . . 2.89 109.877 179.111 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 51.4 mttp -63.82 -47.99 78.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.789 -0.641 . . . . 5.05 110.822 179.503 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 411' ' ' ALA . . . . . 0.41 ' HB1' ' HB1' ' B' ' 422' ' ' ALA . . . -57.32 -51.04 71.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.807 -0.633 . . . . 2.96 112.563 -178.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 5.2 mp -68.78 -31.33 70.28 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.459 0.541 . . . . 3.45 112.459 -179.01 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 8.8 mmtt -69.29 -41.56 76.66 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.083 0.401 . . . . 5.52 112.083 -179.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -81.15 -8.57 59.79 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.7 0.63 . . . . 5.53 112.7 -179.187 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 415' ' ' THR . . . . . 0.435 ' HB ' ' HB3' ' B' ' 418' ' ' ASN . 40.9 p -113.3 -4.83 13.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.792 0.329 . . . . 5.42 110.961 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 56.3 m-20 63.59 58.25 1.34 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.756 -0.656 . . . . 6.37 111.933 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 69.69 8.25 59.98 Favored Glycine 0 C--O 1.229 -0.178 0 CA-C-N 115.616 -0.72 . . . . 4.33 114.089 178.298 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 418' ' ' ASN . . . . . 0.435 ' HB3' ' HB ' ' B' ' 415' ' ' THR . 9.3 t-20 -76.99 82.98 3.51 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 122.324 -0.515 . . . . 6.25 109.734 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -48.16 -47.8 34.77 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 113.61 0.967 . . . . 4.12 113.61 -178.308 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 4.1 pm0 -65.48 -43.36 90.48 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.813 0.34 . . . . 6.99 111.889 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -69.23 -35.47 76.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.148 0.499 . . . . 7.48 110.0 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 422' ' ' ALA . . . . . 0.41 ' HB1' ' HB1' ' B' ' 411' ' ' ALA . . . -65.51 -37.51 87.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.47 -0.786 . . . . 3.68 110.397 179.005 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.585 ' HB1' HD11 ' A' ' 8' ' ' LEU . . . -60.2 -43.36 95.98 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.052 0.454 . . . . 3.8 109.991 179.207 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 65.8 m -74.85 -38.59 61.95 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.958 -0.565 . . . . 5.05 111.514 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.5 -46.23 80.51 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.584 -0.28 . . . . 4.36 111.529 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.58 -33.22 72.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.351 -0.386 . . . . 3.21 111.249 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 427' ' ' PHE . . . . . 0.705 ' CE2' ' HB ' ' A' ' 70' ' ' VAL . 0.1 OUTLIER -70.93 -0.94 10.34 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.332 0.493 . . . . 5.27 112.332 -179.882 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 84.6 mt-30 -70.29 -6.02 31.98 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.089 0.471 . . . . 5.32 110.996 178.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 30.0 m . . . . . 0 C--O 1.246 0.916 0 CA-C-O 118.692 -0.671 . . . . 5.11 109.871 179.036 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 ptt? . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 110.048 -0.352 . . . . 1.65 110.048 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 75.2 mm-40 -103.84 133.47 48.76 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.616 0.246 . . . . 1.92 110.986 -179.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 23.5 pt -129.3 169.34 20.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.31 -0.405 . . . . 1.48 110.04 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.443 ' O ' ' HA ' ' A' ' 66' ' ' THR . 62.4 m-85 -125.45 135.15 52.04 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.423 -0.353 . . . . 2.17 110.23 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.42 HG21 HD12 ' A' ' 15' ' ' LEU . 61.8 t -118.18 120.58 64.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.555 -0.293 . . . . 1.65 110.348 179.574 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.429 ' HE2' HG21 ' A' ' 66' ' ' THR . 38.0 mtmt -96.94 128.6 44.06 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.25 0.547 . . . . 3.16 111.48 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.06 160.07 14.55 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.655 -0.702 . . . . 2.17 110.126 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.645 ' HG ' HG22 ' A' ' 70' ' ' VAL . 0.5 OUTLIER -60.16 -28.16 67.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.78 0.324 . . . . 3.05 111.447 179.97 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.26 29.84 0.22 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.384 -0.371 . . . . 2.7 111.742 -179.597 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 51.66 46.49 53.78 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 121.416 -0.421 . . . . 2.64 112.75 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -126.77 153.67 45.26 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 110.128 -0.323 . . . . 2.34 110.128 -179.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.1 m -128.17 121.42 29.44 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.014 0.435 . . . . 2.31 110.725 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 5.4 mt -106.02 140.06 25.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.03 -0.532 . . . . 1.83 110.544 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.73 135.3 35.17 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.124 -0.324 . . . . 2.02 110.124 179.37 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.585 HD11 HG12 ' A' ' 30' ' ' ILE . 34.9 mt -135.3 137.46 42.48 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.946 0.403 . . . . 1.33 111.522 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -105.66 106.77 17.43 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.691 -0.686 . . . . 2.4 109.229 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 4.2 m -138.98 178.19 4.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.176 -0.466 . . . . 1.25 110.713 -179.058 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -127.13 155.75 75.58 Favored Pre-proline 0 C--N 1.32 -0.682 0 N-CA-C 109.442 -0.577 . . . . 1.85 109.442 179.389 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.605 ' HA ' ' HB2' ' A' ' 56' ' ' LEU . 76.6 Cg_exo -52.34 -29.95 40.93 Favored 'Trans proline' 0 CA--C 1.532 0.378 0 C-N-CA 122.745 2.297 . . . . 1.78 113.017 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.23 -4.37 50.33 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.399 0.518 . . . . 1.8 112.399 -179.524 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.87 135.64 40.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.743 0.306 . . . . 1.23 110.517 -179.73 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.91 145.21 31.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.065 -0.516 . . . . 1.44 110.261 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.527 ' HB ' ' HA ' ' A' ' 52' ' ' ASP . 46.6 mm -55.09 -43.76 71.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 O-C-N 123.111 0.257 . . . . 0.99 111.225 -179.407 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.539 ' HB2' ' HB3' ' A' ' 52' ' ' ASP . 27.6 tt0 -58.63 -38.93 79.13 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.318 -0.401 . . . . 2.22 110.826 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.484 ' O ' ' HG3' ' A' ' 29' ' ' LYS . 64.3 t30 -69.38 -37.34 77.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.244 -0.434 . . . . 1.23 109.939 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.439 ' O ' HG13 ' A' ' 30' ' ' ILE . 97.3 t -62.23 -42.71 96.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.966 -0.561 . . . . 0.64 109.826 179.134 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.3 mtmt -62.81 -34.78 78.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.033 -0.53 . . . . 1.32 110.815 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.56 -38.76 92.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.037 0.446 . . . . 1.08 109.81 178.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.484 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 48.7 mttt -67.57 -32.5 73.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.864 -0.607 . . . . 1.08 110.069 179.278 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.585 HG12 HD11 ' A' ' 15' ' ' LEU . 69.4 mt -69.09 -35.6 69.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.091 -0.504 . . . . 1.31 109.75 179.105 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -65.7 -31.98 73.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.176 -0.465 . . . . 1.93 110.126 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -74.79 -2.5 26.89 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.848 -0.615 . . . . 2.05 110.82 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -121.96 -45.15 2.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.305 -0.407 . . . . 2.17 112.014 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -92.63 -21.84 19.81 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.271 0.471 . . . . 2.14 112.271 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.34 19.39 78.34 Favored Glycine 0 CA--C 1.518 0.256 0 C-N-CA 120.57 -0.824 . . . . 2.01 112.115 -179.375 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.664 HD13 HD21 ' A' ' 71' ' ' LEU . 44.6 mt -104.49 125.73 33.31 Favored Pre-proline 0 C--N 1.327 -0.404 0 N-CA-C 110.337 -0.246 . . . . 1.83 110.337 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.408 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 46.7 Cg_exo -57.8 140.96 95.44 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.835 2.357 . . . . 2.04 112.044 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 37' ' ' PRO . 32.5 Cg_exo -60.11 -18.66 52.44 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 123.126 2.551 . . . . 1.52 112.253 -179.659 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -63.61 -31.71 72.96 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.835 -0.621 . . . . 2.95 110.843 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -102.61 -0.59 31.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.074 -0.512 . . . . 2.56 110.779 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.408 ' HB2' ' HA ' ' A' ' 38' ' ' PRO . 56.3 mt-30 -87.21 120.49 28.55 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.084 -0.507 . . . . 1.4 111.818 -178.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.624 ' HB3' ' HD2' ' B' ' 427' ' ' PHE . 40.8 mtt180 -126.29 124.09 39.55 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.025 -0.731 . . . . 2.65 109.025 178.388 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.571 ' HB3' HD12 ' A' ' 50' ' ' LEU . 85.1 mt -108.92 129.06 55.42 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.898 0.38 . . . . 1.02 111.022 -179.205 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.688 ' HB ' ' CZ ' ' B' ' 427' ' ' PHE . 1.0 OUTLIER -120.67 144.73 28.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 116.062 -0.517 . . . . 2.14 110.366 179.202 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -129.64 101.98 6.15 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.887 -0.783 . . . . 1.71 108.887 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.69 34.31 22.09 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.993 -0.549 . . . . 2.1 110.921 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.74 -9.72 76.85 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 121.038 -0.601 . . . . 1.84 113.358 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -88.72 134.19 33.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.892 0.346 . . . . 3.05 111.522 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -74.82 120.1 19.9 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.512 -0.767 . . . . 2.3 111.232 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.571 HD12 ' HB3' ' A' ' 43' ' ' LEU . 59.1 mt -86.33 110.58 19.76 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.918 -0.401 . . . . 1.17 109.918 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.543 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 33.1 tt0 -74.67 135.74 41.91 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.219 -0.446 . . . . 2.65 111.308 -179.573 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.539 ' HB3' ' HB2' ' A' ' 24' ' ' GLU . 22.2 m-20 -59.93 -31.48 69.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.673 -0.694 . . . . 1.83 111.624 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.543 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -81.93 7.43 62.99 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.924 -0.58 . . . . 1.82 113.4 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 17.7 mmt-85 -115.03 167.74 10.54 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 122.577 -0.366 . . . . 2.69 110.257 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 42.3 p -110.12 176.82 4.91 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.768 0.318 . . . . 1.71 110.615 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.605 ' HB2' ' HA ' ' A' ' 19' ' ' PRO . 80.4 mt -65.62 -36.64 84.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.282 -0.417 . . . . 1.49 111.785 -179.471 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.51 -25.09 66.52 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 111.912 0.338 . . . . 1.94 111.912 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -62.46 -34.8 77.54 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.887 0.375 . . . . 2.03 111.126 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -103.87 15.08 29.49 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.006 -0.543 . . . . 1.76 111.518 -179.265 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 59.45 40.07 21.17 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.436 0.636 . . . . 2.96 111.689 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.459 ' HB ' ' HB3' ' A' ' 56' ' ' LEU . 92.8 mt -83.11 121.66 36.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.929 -0.578 . . . . 1.65 109.883 179.534 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -114.94 -166.23 1.09 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.852 -0.613 . . . . 2.66 110.558 -179.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 42.6 pttt -70.09 148.3 48.93 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.493 -0.321 . . . . 3.22 111.515 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 70.96 0.13 3.27 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 113.149 0.796 . . . . 3.12 113.149 179.358 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 16.7 m -65.31 140.8 58.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.837 0.351 . . . . 1.83 110.393 179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.443 ' HA ' ' O ' ' A' ' 4' ' ' PHE . 3.5 m -104.33 126.92 51.85 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.022 0.439 . . . . 2.03 111.501 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.4 mp -108.0 146.35 32.62 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.801 -0.814 . . . . 1.41 108.801 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.655 ' HB2' HG22 ' A' ' 44' ' ' ILE . 44.4 m80 -105.43 134.93 47.74 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.701 0.286 . . . . 2.76 110.845 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 36.4 tp -119.76 115.72 24.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.131 -0.486 . . . . 1.54 111.394 -179.543 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.645 HG22 ' HG ' ' A' ' 8' ' ' LEU . 9.1 t -120.18 129.27 75.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.947 -0.569 . . . . 1.79 109.623 178.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.664 HD21 HD13 ' A' ' 36' ' ' ILE . 58.5 mt -71.5 126.48 29.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.101 -0.499 . . . . 2.43 110.916 -179.635 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.5 92.63 7.65 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.886 -0.597 . . . . 3.19 110.508 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 84.1 mt -77.72 128.77 34.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.276 -0.42 . . . . 2.99 110.799 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.4 mmm180 -98.56 -44.92 6.28 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.2 -0.455 . . . . 3.67 110.401 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -94.21 91.04 1.4 Allowed Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.685 -0.769 . . . . 3.08 111.799 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.438 -1.201 . . . . 3.82 111.456 -179.851 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.762 0 N-CA-C 112.072 -0.411 . . . . 5.66 112.072 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.65 87.03 7.34 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.123 0.487 . . . . 5.53 110.526 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -87.39 82.82 7.44 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.066 -0.515 . . . . 3.98 111.223 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.09 -25.35 63.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.911 -0.586 . . . . 4.15 110.67 179.199 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 390' ' ' PHE . . . . . 0.799 ' HB2' HD11 ' B' ' 395' ' ' ILE . 0.1 OUTLIER -119.27 110.71 37.39 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.826 -0.625 . . . . 2.51 110.824 -179.992 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -65.35 146.92 86.94 Favored 'Trans proline' 0 C--O 1.234 0.313 0 C-N-CA 122.924 2.416 . . . . 3.77 112.13 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.23 -56.55 13.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.488 -0.778 . . . . 5.36 112.917 -178.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -61.51 -43.79 98.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.268 -0.424 . . . . 6.89 111.682 -179.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 394' ' ' THR . . . . . 0.539 HG23 ' HB2' ' B' ' 419' ' ' ALA . 22.3 m -55.61 -48.6 74.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.976 -0.556 . . . . 4.2 111.439 -179.73 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 395' ' ' ILE . . . . . 0.799 HD11 ' HB2' ' B' ' 390' ' ' PHE . 84.0 mt -61.62 -50.05 81.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.856 0.36 . . . . 3.8 110.266 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -56.6 -45.43 81.42 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.981 0.734 . . . . 6.27 112.981 -178.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.58 -33.2 75.36 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.871 -0.331 . . . . 6.91 111.519 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 84.6 mt -78.74 -25.25 44.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.849 0.356 . . . . 4.31 111.268 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 399' ' ' MET . . . . . 0.595 ' HG2' ' O ' ' B' ' 395' ' ' ILE . 31.7 mmt -73.92 -24.87 59.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.072 0.463 . . . . 5.8 109.891 179.252 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -61.27 -30.19 70.31 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.516 -0.765 . . . . 7.71 111.366 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 401' ' ' LEU . . . . . 0.548 ' HB2' ' HD2' ' B' ' 403' ' ' PHE . 9.8 mt -65.4 -15.35 62.5 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.955 -0.566 . . . . 5.69 111.443 -179.776 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 98.0 39.25 3.86 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.735 -0.745 . . . . 5.87 112.082 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 403' ' ' PHE . . . . . 0.548 ' HD2' ' HB2' ' B' ' 401' ' ' LEU . 78.8 m-85 -120.12 154.84 56.02 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-O 120.413 0.149 . . . . 4.83 110.714 -179.725 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -78.79 158.19 27.87 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.526 2.151 . . . . 4.72 112.386 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.594 ' O ' HG12 ' B' ' 408' ' ' VAL . 11.4 ttt85 -63.8 -32.01 73.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.834 -0.621 . . . . 4.16 110.838 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -61.46 -40.3 94.03 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.956 0.408 . . . . 4.69 110.54 179.002 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -65.77 -39.01 90.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.77 -0.65 . . . . 2.99 111.37 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 408' ' ' VAL . . . . . 0.594 HG12 ' O ' ' B' ' 405' ' ' ARG . 1.4 p -66.44 -35.03 73.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 C-N-CA 120.896 -0.322 . . . . 2.06 111.367 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 409' ' ' VAL . . . . . 0.426 HG23 ' O ' ' B' ' 405' ' ' ARG . 84.8 t -67.14 -44.62 87.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.99 0.424 . . . . 2.89 109.892 179.517 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -62.96 -47.06 84.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.812 -0.631 . . . . 5.05 110.587 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -63.94 -45.83 87.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.894 -0.594 . . . . 2.96 110.859 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.94 HD13 ' HA2' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -59.77 -51.44 69.73 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.432 0.531 . . . . 3.45 112.432 -179.262 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 5.9 mtpm? -60.51 -31.47 70.54 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.459 0.541 . . . . 5.52 112.459 -179.153 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -87.86 -18.85 28.32 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 113.362 0.875 . . . . 5.53 113.362 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 35.0 p -107.62 3.99 25.4 Favored 'General case' 0 C--O 1.236 0.36 0 O-C-N 121.858 -0.526 . . . . 5.42 111.77 -178.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 67.71 50.83 0.85 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.869 -0.605 . . . . 6.37 111.202 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.94 ' HA2' HD13 ' B' ' 412' ' ' LEU . . . 66.15 -27.33 0.16 Allowed Glycine 0 CA--C 1.528 0.848 0 N-CA-C 117.373 1.709 . . . . 4.33 117.373 176.797 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -58.9 113.98 2.33 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 118.588 1.194 . . . . 6.25 113.199 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 419' ' ' ALA . . . . . 0.539 ' HB2' HG23 ' B' ' 394' ' ' THR . . . -61.02 -26.01 67.3 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.33 -0.85 . . . . 4.12 113.252 -178.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 420' ' ' GLU . . . . . 0.402 ' H ' ' HG2' ' B' ' 420' ' ' GLU . 5.2 mm-40 -59.24 -56.35 23.29 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.585 0.707 . . . . 6.99 110.667 -179.803 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -74.95 -29.79 61.03 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.769 -0.65 . . . . 7.48 110.43 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 422' ' ' ALA . . . . . 0.466 ' HB3' ' HA ' ' B' ' 419' ' ' ALA . . . -60.47 -48.53 81.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.702 -0.681 . . . . 3.68 110.193 179.239 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.518 ' O ' ' HB2' ' B' ' 427' ' ' PHE . . . -62.81 -38.78 92.06 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.873 -0.603 . . . . 3.8 110.006 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 69.0 m -64.28 -31.53 72.77 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.038 -0.528 . . . . 5.05 110.731 178.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 425' ' ' LEU . . . . . 0.619 ' O ' ' HG2' ' B' ' 428' ' ' GLN . 1.1 mm? -81.9 -48.94 10.91 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 112.903 0.705 . . . . 4.36 112.903 -179.316 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.5 pp -64.02 -33.21 75.22 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.768 0.655 . . . . 3.21 112.768 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 427' ' ' PHE . . . . . 0.688 ' CZ ' ' HB ' ' A' ' 44' ' ' ILE . 0.2 OUTLIER -69.3 -1.24 7.64 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 113.893 1.071 . . . . 5.27 113.893 -179.052 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 428' ' ' GLN . . . . . 0.619 ' HG2' ' O ' ' B' ' 425' ' ' LEU . 11.8 pt20 -113.89 23.45 13.0 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.499 0.555 . . . . 5.32 112.499 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 13.3 m . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.584 -0.722 . . . . 5.11 110.302 179.526 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ptt? . . . . . 0 N--CA 1.482 1.152 0 N-CA-C 110.179 -0.304 . . . . 1.65 110.179 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 46.0 mm-40 -107.84 142.62 37.63 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.583 0.23 . . . . 1.92 110.796 -179.498 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 18.1 pt -130.89 153.75 39.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.399 -0.364 . . . . 1.48 110.258 179.249 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -105.16 119.54 39.3 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.544 -0.298 . . . . 2.17 110.597 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.42 ' O ' ' HA ' ' A' ' 12' ' ' THR . 21.3 t -103.16 119.35 51.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 110.027 -0.36 . . . . 1.65 110.027 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -103.12 131.74 49.91 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.266 -0.424 . . . . 3.16 110.983 -179.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.71 161.5 13.57 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.139 -0.482 . . . . 2.17 109.877 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.502 HD11 HG13 ' A' ' 70' ' ' VAL . 78.0 mt -59.39 -23.6 62.74 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.258 0.466 . . . . 3.05 112.258 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -79.91 -8.08 59.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.98 0.419 . . . . 2.7 111.699 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.12 3.01 57.97 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.765 -0.731 . . . . 2.64 111.968 -179.547 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -75.44 146.47 40.69 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.457 -0.571 . . . . 2.34 109.457 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.42 ' HA ' ' O ' ' A' ' 5' ' ' VAL . 2.2 m -139.26 119.71 13.92 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.726 0.298 . . . . 2.31 110.897 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 24.4 pt -119.33 148.83 22.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.537 -0.301 . . . . 1.83 110.818 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 6.6 m -103.91 111.64 24.26 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.918 0.389 . . . . 2.02 110.391 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.422 HD21 ' HG3' ' A' ' 33' ' ' LYS . 72.5 mt -104.47 152.39 22.4 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.22 -0.445 . . . . 1.33 111.126 -179.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -98.96 121.23 40.65 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.882 -0.599 . . . . 2.4 110.739 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 5.8 m -138.5 163.58 28.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 116.158 -0.474 . . . . 1.25 110.684 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.541 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 20.5 mm-40 -117.94 158.3 46.25 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 116.034 -0.53 . . . . 1.85 109.778 179.378 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -58.29 -23.65 63.75 Favored 'Trans proline' 0 N--CA 1.475 0.405 0 C-N-CA 122.607 2.205 . . . . 1.78 112.388 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -92.71 3.76 55.01 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.171 -0.468 . . . . 1.8 111.599 -179.595 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.541 ' HB2' ' O ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -77.45 130.46 37.05 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 120.833 0.349 . . . . 1.23 110.916 -179.69 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.22 155.23 27.46 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.131 -0.692 . . . . 1.44 109.131 178.627 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.596 ' HB ' ' HA ' ' A' ' 52' ' ' ASP . 43.7 mm -58.59 -38.18 69.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 120.518 0.199 . . . . 0.99 111.347 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -60.62 -34.91 74.95 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.114 0.483 . . . . 2.22 110.3 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.423 ' O ' ' HG3' ' A' ' 29' ' ' LYS . 8.4 m-20 -65.0 -36.14 83.45 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 115.98 -0.555 . . . . 1.23 110.377 179.769 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 22.0 t -66.04 -38.63 82.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.076 -0.511 . . . . 0.64 109.648 179.239 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 23' ' ' ILE . 4.5 mmmm -61.0 -40.9 95.29 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.723 -0.671 . . . . 1.32 109.948 179.369 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.67 -36.08 82.63 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.638 -0.71 . . . . 1.08 110.588 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 87.4 mttt -68.52 -39.93 81.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.423 -0.353 . . . . 1.08 110.47 179.539 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 81.7 mt -66.8 -36.32 76.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 109.41 -0.589 . . . . 1.31 109.41 178.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -66.82 -33.48 75.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.76 -0.654 . . . . 1.93 110.038 179.183 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -69.41 -34.56 74.66 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.699 -0.682 . . . . 2.05 110.821 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.422 ' HG3' HD21 ' A' ' 15' ' ' LEU . 74.3 mmtt -84.88 -61.46 1.77 Allowed 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.581 0.585 . . . . 2.17 112.581 -179.242 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -80.73 -45.94 16.29 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 113.089 0.774 . . . . 2.14 113.089 -177.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 99.33 25.44 9.42 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.517 -0.849 . . . . 2.01 111.576 -178.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 71.9 mt -98.62 127.66 35.1 Favored Pre-proline 0 C--N 1.326 -0.451 0 N-CA-C 109.617 -0.512 . . . . 1.83 109.617 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.424 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 77.5 Cg_exo -50.97 133.41 40.42 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.991 2.461 . . . . 2.04 112.104 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 37' ' ' PRO . 32.2 Cg_exo -59.53 -19.68 53.42 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 123.338 2.692 . . . . 1.52 112.625 -179.496 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -21.14 58.52 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.349 -0.387 . . . . 2.95 110.92 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -98.14 -13.9 20.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.139 0.495 . . . . 2.56 110.373 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -78.84 122.83 26.57 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.809 -0.632 . . . . 1.4 111.951 -179.1 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.453 ' HD2' ' OE1' ' A' ' 49' ' ' GLN . 14.1 mmt85 -121.44 107.61 12.67 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.189 -0.671 . . . . 2.65 109.189 177.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.807 ' HB3' HD12 ' A' ' 50' ' ' LEU . 69.7 mt -91.87 125.47 36.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.084 -0.507 . . . . 1.02 112.309 -178.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.631 ' HB ' ' HB2' ' A' ' 68' ' ' HIS . 43.9 mt -117.23 146.18 22.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.639 -0.709 . . . . 2.14 109.816 179.536 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -132.8 93.16 3.16 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.39 -0.368 . . . . 1.71 110.36 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 56.29 50.46 13.27 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 113.002 0.741 . . . . 2.1 113.002 179.21 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.417 ' HA2' ' HA3' ' B' ' 402' ' ' GLY . . . 96.63 -38.69 3.01 Favored Glycine 0 CA--C 1.517 0.172 0 C-N-CA 120.721 -0.752 . . . . 1.84 113.525 179.193 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -85.8 153.27 22.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.67 0.235 . . . . 3.05 110.513 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.453 ' OE1' ' HD2' ' A' ' 42' ' ' ARG . 9.9 tt0 -97.77 145.57 26.24 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.998 0.428 . . . . 2.3 111.031 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.807 HD12 ' HB3' ' A' ' 43' ' ' LEU . 73.0 mt -89.71 122.97 33.32 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.652 -0.703 . . . . 1.17 110.441 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.581 ' HB3' ' HG2' ' A' ' 54' ' ' ARG . 0.1 OUTLIER -88.83 130.14 35.44 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.094 -0.503 . . . . 2.65 110.225 -179.721 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.596 ' HA ' ' HB ' ' A' ' 23' ' ' ILE . 35.7 m-20 -54.69 -28.31 46.75 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.045 0.387 . . . . 1.83 112.045 -179.438 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -85.38 10.86 62.65 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.918 -0.658 . . . . 1.82 113.231 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.581 ' HG2' ' HB3' ' A' ' 51' ' ' GLU . 81.6 mmt-85 -115.75 169.92 8.84 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 117.011 0.405 . . . . 2.69 110.866 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 25.9 p -111.61 166.16 11.39 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.773 -0.649 . . . . 1.71 109.638 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.456 HD12 ' O ' ' A' ' 18' ' ' GLU . 83.7 mt -64.16 -28.45 69.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.067 0.461 . . . . 1.49 110.942 179.502 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.8 m -73.08 -19.59 61.13 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.866 -0.606 . . . . 1.94 111.698 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -66.7 -34.22 77.36 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.103 0.478 . . . . 2.03 110.65 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.41 ' HB2' HG13 ' A' ' 61' ' ' ILE . 60.3 m-85 -101.69 8.95 41.41 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.807 -0.633 . . . . 1.76 109.934 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 53.37 49.71 19.12 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.653 -0.703 . . . . 2.96 110.512 -179.113 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.41 HG13 ' HB2' ' A' ' 59' ' ' TYR . 79.8 mt -81.67 106.88 13.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.47 -0.786 . . . . 1.65 110.003 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -84.76 177.98 7.81 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.718 -0.674 . . . . 2.66 110.399 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.87 148.66 51.64 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.199 -0.455 . . . . 3.22 110.173 179.234 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 74.17 8.69 4.63 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 113.065 0.765 . . . . 3.12 113.065 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.6 m -70.94 150.35 45.8 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 122.13 -0.357 . . . . 1.83 110.958 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.6 m -104.14 127.71 51.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.047 0.451 . . . . 2.03 111.109 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.8 mp -111.08 145.75 38.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.669 -0.696 . . . . 1.41 109.314 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.631 ' HB2' ' HB ' ' A' ' 44' ' ' ILE . 65.3 m80 -102.74 129.7 49.45 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.749 0.309 . . . . 2.76 111.631 -179.502 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 51.6 tp -110.12 105.68 14.86 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.945 -0.571 . . . . 1.54 110.483 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.502 HG13 HD11 ' A' ' 8' ' ' LEU . 62.6 t -98.01 137.0 26.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 115.884 -0.598 . . . . 1.79 110.424 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 66.9 mt -86.62 107.95 18.4 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.047 -0.524 . . . . 2.43 109.625 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.479 HH21 ' HA ' ' B' ' 428' ' ' GLN . 0.4 OUTLIER -104.13 95.3 5.88 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.241 -0.436 . . . . 3.19 111.037 -179.404 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 42.7 mt -80.56 161.7 24.65 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.045 -0.525 . . . . 2.99 109.625 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.1 mmt180 -104.77 7.75 34.73 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.856 0.36 . . . . 3.67 110.994 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -174.19 -170.68 37.76 Favored Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 111.135 -0.786 . . . . 3.08 111.135 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.827 -0.985 . . . . 3.82 111.507 -179.882 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.826 0 N-CA-C 111.864 -0.495 . . . . 5.66 111.864 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 35.5 m -143.0 39.88 1.48 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.124 0.488 . . . . 5.53 110.72 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -73.93 105.11 5.04 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.9 -0.591 . . . . 3.98 111.056 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.15 -18.72 52.62 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.956 -0.566 . . . . 4.15 110.549 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 390' ' ' PHE . . . . . 0.587 ' HD1' HD11 ' B' ' 395' ' ' ILE . 0.5 OUTLIER -141.62 112.23 6.43 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.868 -0.606 . . . . 2.51 110.721 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 391' ' ' PRO . . . . . 0.454 ' O ' HG13 ' B' ' 395' ' ' ILE . 32.0 Cg_exo -60.16 149.98 81.98 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 122.87 2.38 . . . . 3.77 112.421 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -53.51 -46.45 70.09 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.651 -0.704 . . . . 5.36 112.719 -179.046 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 393' ' ' GLN . . . . . 0.511 ' O ' ' HG2' ' B' ' 397' ' ' GLN . 41.6 tt0 -54.88 -51.29 66.43 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.828 0.347 . . . . 6.89 111.499 -179.482 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -39.72 86.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.948 -0.569 . . . . 4.2 111.736 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 395' ' ' ILE . . . . . 0.587 HD11 ' HD1' ' B' ' 390' ' ' PHE . 73.3 mt -61.71 -51.36 73.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-O 120.884 0.373 . . . . 3.8 109.996 179.63 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -55.12 -33.68 63.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.788 -0.642 . . . . 6.27 112.57 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 397' ' ' GLN . . . . . 0.511 ' HG2' ' O ' ' B' ' 393' ' ' GLN . 19.9 mm-40 -69.32 -53.57 18.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.941 0.4 . . . . 6.91 110.822 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 88.8 mt -67.57 -29.45 68.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.023 -0.535 . . . . 4.31 112.3 -178.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 28.6 mmt -68.96 -27.57 65.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.62 0.248 . . . . 5.8 111.45 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -71.45 -19.57 62.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.044 -0.525 . . . . 7.71 111.537 -179.151 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 47.5 mt -69.62 -26.53 64.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.231 -0.441 . . . . 5.69 110.966 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 402' ' ' GLY . . . . . 0.417 ' HA3' ' HA2' ' A' ' 47' ' ' GLY . . . 112.83 6.75 22.67 Favored Glycine 0 N--CA 1.453 -0.172 0 C-N-CA 120.685 -0.769 . . . . 5.87 112.567 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -89.64 150.14 43.62 Favored Pre-proline 0 C--N 1.328 -0.354 0 N-CA-C 110.393 -0.225 . . . . 4.83 110.393 179.753 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -72.65 156.47 53.52 Favored 'Trans proline' 0 C--O 1.236 0.393 0 C-N-CA 122.457 2.105 . . . . 4.72 111.347 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.422 HH11 ' HD3' ' B' ' 405' ' ' ARG . 36.3 ttt-85 -60.65 -30.7 70.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.51 -0.314 . . . . 4.16 111.498 -179.439 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -58.89 -38.69 79.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.332 -0.395 . . . . 4.69 110.844 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -62.37 -38.56 90.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.968 -0.56 . . . . 2.99 110.041 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 408' ' ' VAL . . . . . 0.672 HG13 HD23 ' B' ' 412' ' ' LEU . 2.6 t -65.33 -43.53 94.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.898 -0.592 . . . . 2.06 110.647 179.59 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 409' ' ' VAL . . . . . 0.412 ' O ' ' HB2' ' B' ' 413' ' ' LYS . 48.7 t -57.06 -49.03 80.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.248 -0.433 . . . . 2.89 110.45 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 75.6 mttt -68.08 -48.0 66.72 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.94 -0.573 . . . . 5.05 111.717 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -60.75 -50.71 72.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.321 0.489 . . . . 2.96 112.321 -179.171 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.672 HD23 HG13 ' B' ' 408' ' ' VAL . 3.8 mm? -65.17 -30.83 71.78 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.466 0.543 . . . . 3.45 112.466 -178.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 413' ' ' LYS . . . . . 0.412 ' HB2' ' O ' ' B' ' 409' ' ' VAL . 6.8 mmtt -68.84 -37.97 79.5 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 111.83 0.308 . . . . 5.52 111.83 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -87.68 -8.13 56.52 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 113.018 0.748 . . . . 5.53 113.018 -179.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 415' ' ' THR . . . . . 0.532 HG21 ' HA ' ' B' ' 422' ' ' ALA . 25.1 p -109.22 -19.39 13.34 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 120.934 0.397 . . . . 5.42 111.574 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 68.3 62.1 0.38 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.19 0.811 . . . . 6.37 113.19 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 79.44 -23.34 3.47 Favored Glycine 0 CA--C 1.521 0.465 0 N-CA-C 115.547 0.979 . . . . 4.33 115.547 177.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -65.94 103.33 0.91 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 117.585 0.692 . . . . 6.25 110.546 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -67.13 -38.72 86.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.914 -0.585 . . . . 4.12 111.614 -179.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -66.24 -38.74 88.6 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-O 121.299 0.571 . . . . 6.99 110.018 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -72.92 -36.01 67.17 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.876 -0.787 . . . . 7.48 108.876 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 422' ' ' ALA . . . . . 0.532 ' HA ' HG21 ' B' ' 415' ' ' THR . . . -62.69 -43.25 99.29 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.734 -0.666 . . . . 3.68 110.161 178.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.481 ' HB1' ' CG1' ' A' ' 70' ' ' VAL . . . -61.16 -38.18 85.54 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.215 0.531 . . . . 3.8 110.151 179.282 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 17.7 m -72.35 -34.85 68.31 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.53 -0.759 . . . . 5.05 110.45 178.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -71.53 -46.12 60.48 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.993 -0.548 . . . . 4.36 111.715 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.7 pp -65.41 -34.08 77.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.107 0.479 . . . . 3.21 111.136 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 427' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -77.16 2.88 14.03 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 113.405 0.891 . . . . 5.27 113.405 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 428' ' ' GLN . . . . . 0.479 ' HA ' HH21 ' A' ' 72' ' ' ARG . 2.5 pt20 -57.66 -23.42 51.24 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 120.799 0.333 . . . . 5.32 110.76 178.744 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.667 -0.682 . . . . 5.11 110.276 179.699 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.455 ' HB2' ' HB3' ' A' ' 63' ' ' LYS . 26.1 ptt? . . . . . 0 N--CA 1.483 1.209 0 CA-C-O 120.569 0.223 . . . . 1.65 110.694 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 71.0 mm-40 -112.48 145.31 40.44 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.901 0.381 . . . . 1.92 111.953 -179.095 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 20.2 pt -130.12 155.04 41.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.993 -0.549 . . . . 1.48 109.54 178.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -111.14 115.14 28.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.736 0.303 . . . . 2.17 110.899 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.6 t -99.97 119.79 48.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.389 -0.368 . . . . 1.65 110.615 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.7 ' HE3' HG21 ' A' ' 66' ' ' THR . 89.5 mttt -94.57 128.98 41.56 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.299 -0.41 . . . . 3.16 110.566 179.618 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.22 163.65 12.31 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.206 -0.452 . . . . 2.17 110.088 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 27.9 mt -62.85 -20.8 65.44 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.937 0.399 . . . . 3.05 111.72 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.3 p -81.84 -3.76 54.83 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.245 -0.434 . . . . 2.7 110.846 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.78 -6.87 77.19 Favored Glycine 0 C--N 1.335 0.492 0 N-CA-C 111.369 -0.692 . . . . 2.64 111.369 -179.091 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -68.32 149.67 49.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.35 -0.425 . . . . 2.34 110.811 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.3 m -126.19 128.37 47.14 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.366 -0.605 . . . . 2.31 109.366 178.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.2 mt -113.35 129.45 69.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.651 -0.25 . . . . 1.83 111.461 -178.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.96 110.03 22.31 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.995 -0.743 . . . . 2.02 108.995 178.634 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.7 mt -114.77 142.05 47.05 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.513 0.56 . . . . 1.33 112.513 -178.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -84.44 120.24 26.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.423 -0.808 . . . . 2.4 109.401 179.068 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 15.3 m -142.34 178.8 2.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 116.146 -0.479 . . . . 1.25 109.998 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -145.71 163.26 32.3 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 109.019 -0.734 . . . . 1.85 109.019 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -55.82 -27.04 60.41 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.418 2.078 . . . . 1.78 112.758 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.07 11.44 18.44 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.301 -0.409 . . . . 1.8 111.78 -179.6 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -86.66 134.17 33.63 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.031 -0.359 . . . . 1.23 110.031 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.41 ' O ' HG23 ' A' ' 26' ' ' VAL . 0.7 OUTLIER -92.36 148.69 21.92 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.38 -0.373 . . . . 1.44 110.698 -179.96 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.607 ' HB ' ' HA ' ' A' ' 52' ' ' ASP . 44.8 mm -55.36 -41.1 60.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.376 -0.374 . . . . 0.99 111.792 -179.59 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -65.17 -30.04 70.92 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.881 0.372 . . . . 2.22 111.266 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -76.2 -37.21 58.09 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.586 -0.524 . . . . 1.23 109.586 179.474 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 22' ' ' THR . 66.8 t -64.76 -37.13 79.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.854 -0.612 . . . . 0.64 109.922 178.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -60.52 -37.1 80.07 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.79 -0.641 . . . . 1.32 111.074 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.29 -36.66 84.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 1.08 110.282 179.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 87.0 mttt -65.72 -38.23 88.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.835 -0.62 . . . . 1.08 110.265 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 47.3 mt -70.32 -30.95 45.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.176 -0.465 . . . . 1.31 110.312 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -71.09 -34.54 71.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.96 0.409 . . . . 1.93 110.205 179.181 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -72.59 -33.68 66.9 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.145 0.497 . . . . 2.05 110.681 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -83.62 -63.11 1.41 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.026 -0.534 . . . . 2.17 112.43 -179.584 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -79.7 -48.61 13.39 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.479 0.548 . . . . 2.14 112.479 -178.398 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 115.8 -12.2 17.94 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.707 -0.759 . . . . 2.01 111.727 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.424 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 13.0 mt -68.57 124.29 89.67 Favored Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 110.338 -0.245 . . . . 1.83 110.338 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.443 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 33.6 Cg_exo -63.12 143.62 90.65 Favored 'Trans proline' 0 C--O 1.233 0.274 0 C-N-CA 122.84 2.36 . . . . 2.04 111.457 179.275 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 37' ' ' PRO . 50.0 Cg_exo -56.7 -23.64 50.57 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.332 2.688 . . . . 1.52 112.297 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.96 -23.41 65.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.97 -0.559 . . . . 2.95 110.612 179.55 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.403 ' HA ' ' HB3' ' A' ' 72' ' ' ARG . 32.9 mt-30 -112.06 9.37 20.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.955 -0.566 . . . . 2.56 110.543 -179.347 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -97.0 100.16 11.68 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.767 -0.651 . . . . 1.4 111.244 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 52.4 mtp180 -104.46 103.89 13.66 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.05 -0.722 . . . . 2.65 109.05 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.3 mp -104.51 144.1 32.14 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.885 0.698 . . . . 1.02 112.885 -178.424 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.596 HG13 ' HB2' ' A' ' 68' ' ' HIS . 1.0 OUTLIER -135.44 151.37 30.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.36 -0.836 . . . . 2.14 110.268 179.048 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.481 ' HB2' HD21 ' A' ' 50' ' ' LEU . 61.6 t80 -121.02 87.74 2.81 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.104 -0.702 . . . . 1.71 109.104 178.643 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 56.1 65.86 1.34 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.826 -0.625 . . . . 2.1 111.946 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 76.13 -9.28 19.86 Favored Glycine 0 CA--C 1.521 0.467 0 CA-C-N 115.801 -0.636 . . . . 1.84 114.301 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.424 ' HE2' ' O ' ' A' ' 45' ' ' PHE . 27.3 mtmm -100.88 124.61 46.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 117.25 0.525 . . . . 3.05 111.192 -179.508 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -75.43 134.55 40.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.25 -0.432 . . . . 2.3 110.489 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.481 HD21 ' HB2' ' A' ' 45' ' ' PHE . 36.8 mt -93.07 125.56 37.72 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.295 -0.411 . . . . 1.17 111.24 -179.268 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.428 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 32.3 tt0 -89.11 132.16 34.93 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.81 -0.441 . . . . 2.65 109.81 179.199 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.607 ' HA ' ' HB ' ' A' ' 23' ' ' ILE . 24.0 m-20 -56.19 -30.66 62.57 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.974 0.731 . . . . 1.83 112.974 -178.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.428 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -87.72 18.23 40.22 Favored Glycine 0 CA--C 1.519 0.286 0 C-N-CA 120.948 -0.644 . . . . 1.82 113.356 -179.402 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 22.4 mmm-85 -120.28 163.61 17.55 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.966 0.383 . . . . 2.69 111.099 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.472 ' O ' ' HB2' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -103.42 169.19 8.68 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.674 -0.694 . . . . 1.71 110.211 179.753 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.444 ' HB3' ' HB ' ' A' ' 61' ' ' ILE . 72.8 mt -63.33 -33.84 76.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.824 0.345 . . . . 1.49 111.527 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.08 -19.1 65.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.188 -0.46 . . . . 1.94 111.329 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.472 ' HB2' ' O ' ' A' ' 55' ' ' THR . 1.5 m-20 -65.38 -31.15 72.11 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 116.233 -0.439 . . . . 2.03 111.548 -179.669 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.444 ' HB2' HG13 ' A' ' 61' ' ' ILE . 47.1 m-85 -111.91 14.23 20.91 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.287 -0.415 . . . . 1.76 110.407 -179.399 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 48.8 t30 59.67 34.14 22.08 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.455 -0.793 . . . . 2.96 111.289 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.444 ' HB ' ' HB3' ' A' ' 56' ' ' LEU . 72.7 mt -75.66 109.8 9.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.848 -0.615 . . . . 1.65 109.725 179.426 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -106.14 -166.6 1.21 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.871 -0.604 . . . . 2.66 110.685 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.455 ' HB3' ' HB2' ' A' ' 1' ' ' MET . 8.3 pttm -68.95 145.26 53.78 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.409 -0.359 . . . . 3.22 110.993 179.499 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 71.74 8.34 6.09 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.495 0.924 . . . . 3.12 113.495 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.436 ' HB3' ' HE1' ' A' ' 45' ' ' PHE . 28.1 m -72.03 143.31 49.19 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.754 0.312 . . . . 1.83 110.262 179.22 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.7 HG21 ' HE3' ' A' ' 6' ' ' LYS . 0.2 OUTLIER -100.43 125.7 46.75 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.192 -0.458 . . . . 2.03 111.21 -179.666 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.0 mp -114.54 146.14 41.1 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.491 -0.929 . . . . 1.41 108.491 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.596 ' HB2' HG13 ' A' ' 44' ' ' ILE . 63.8 m80 -109.63 137.63 47.17 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 120.726 0.298 . . . . 2.76 111.56 -179.046 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 52.0 tp -118.35 116.48 26.83 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.934 -0.575 . . . . 1.54 111.128 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 22.9 t -98.71 129.28 49.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.691 -0.686 . . . . 1.79 109.648 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 58.3 mt -76.06 117.74 18.09 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.769 -0.65 . . . . 2.43 111.106 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.403 ' HB3' ' HA ' ' A' ' 40' ' ' GLN . 60.3 ttt180 -93.27 103.15 15.42 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.832 -0.622 . . . . 3.19 110.815 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 34.9 mt -78.8 120.88 24.07 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.099 -0.501 . . . . 2.99 110.71 179.432 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 -83.71 -49.58 8.99 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.255 -0.429 . . . . 3.67 110.669 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -133.45 113.99 1.3 Allowed Glycine 0 N--CA 1.445 -0.738 0 C-N-CA 120.723 -0.751 . . . . 3.08 111.675 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.521 -1.155 . . . . 3.82 111.304 179.688 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.355 0 N-CA-C 111.821 -0.512 . . . . 5.66 111.821 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -84.09 54.67 3.02 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.177 0.513 . . . . 5.53 110.517 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -83.65 71.79 10.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.006 -0.543 . . . . 3.98 110.564 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.3 -31.79 70.5 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.639 -0.709 . . . . 4.15 111.049 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 390' ' ' PHE . . . . . 0.406 ' HA ' ' HD3' ' B' ' 391' ' ' PRO . 26.0 m-85 -109.69 121.1 43.16 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 115.865 -0.607 . . . . 2.51 110.439 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 391' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' B' ' 390' ' ' PHE . 15.3 Cg_exo -70.04 130.87 19.71 Favored 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.792 2.328 . . . . 3.77 111.359 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -50.67 -49.22 57.72 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.886 0.699 . . . . 5.36 112.886 -179.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -60.22 -42.15 94.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.437 -0.347 . . . . 6.89 111.086 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 11.2 m -63.74 -43.4 96.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.037 -0.528 . . . . 4.2 110.969 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 395' ' ' ILE . . . . . . . . . . . . . 84.8 mt -59.14 -49.27 83.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.493 -0.321 . . . . 3.8 110.685 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -61.51 -42.95 99.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.007 -0.542 . . . . 6.27 111.281 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -64.6 -44.67 89.87 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.777 0.322 . . . . 6.91 111.217 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 98.1 mt -66.59 -37.97 86.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 4.31 111.717 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 399' ' ' MET . . . . . 0.401 ' HA ' ' O ' ' B' ' 403' ' ' PHE . 39.0 mtp -67.51 -32.79 73.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.459 -0.337 . . . . 5.8 111.397 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -65.66 -28.55 69.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.267 -0.424 . . . . 7.71 111.215 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 401' ' ' LEU . . . . . 0.432 HD22 ' HB3' ' A' ' 68' ' ' HIS . 14.3 mt -64.97 -18.46 65.29 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.131 0.491 . . . . 5.69 110.681 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 107.91 23.28 6.85 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.76 -0.655 . . . . 5.87 111.524 -179.356 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 403' ' ' PHE . . . . . 0.401 ' O ' ' HA ' ' B' ' 399' ' ' MET . 39.9 m-85 -114.38 139.44 23.88 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-O 120.768 0.318 . . . . 4.83 110.806 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -77.16 164.39 29.39 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.671 2.248 . . . . 4.72 112.056 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 56.3 mtt180 -60.11 -28.06 67.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.835 -0.62 . . . . 4.16 110.798 179.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -58.07 -44.65 87.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.712 -0.676 . . . . 4.69 110.675 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -67.66 -36.3 80.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.635 -0.711 . . . . 2.99 110.117 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 91.0 t -60.96 -53.27 51.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.659 -0.7 . . . . 2.06 110.521 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 88.1 t -54.8 -49.51 68.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.136 -0.484 . . . . 2.89 112.046 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -66.23 -49.51 66.98 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.747 0.647 . . . . 5.05 112.747 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -64.16 -48.5 75.76 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.374 0.509 . . . . 2.96 112.374 -178.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -62.72 -39.82 95.24 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.463 0.542 . . . . 3.45 112.463 -178.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 13.4 mmmt -64.26 -42.29 96.53 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.147 0.425 . . . . 5.52 112.147 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -77.87 -8.91 58.71 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.478 0.547 . . . . 5.53 112.478 -179.21 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 25.3 p -113.3 8.23 17.99 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.754 0.311 . . . . 5.42 111.63 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 61.33 39.78 15.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.071 -0.513 . . . . 6.37 112.362 179.198 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 79.7 -15.68 13.56 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.715 -0.755 . . . . 4.33 114.194 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 418' ' ' ASN . . . . . 0.78 HD21 ' HB2' ' B' ' 421' ' ' PHE . 0.1 OUTLIER -67.9 106.06 2.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 117.973 0.886 . . . . 6.25 110.99 -179.916 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 419' ' ' ALA . . . . . 0.453 ' HA ' ' HB3' ' B' ' 422' ' ' ALA . . . -62.59 -25.8 68.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.969 -1.014 . . . . 4.12 112.903 -178.241 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -60.18 -56.4 22.09 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.2 0.524 . . . . 6.99 110.69 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 421' ' ' PHE . . . . . 0.78 ' HB2' HD21 ' B' ' 418' ' ' ASN . 23.4 m-85 -73.86 -29.27 62.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.081 -0.509 . . . . 7.48 110.415 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 422' ' ' ALA . . . . . 0.453 ' HB3' ' HA ' ' B' ' 419' ' ' ALA . . . -61.4 -46.56 89.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.297 -0.41 . . . . 3.68 110.557 179.291 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -64.78 -38.52 91.28 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.982 -0.554 . . . . 3.8 110.381 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 1.3 t -70.1 -26.15 63.84 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.13 -0.486 . . . . 5.05 110.503 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 425' ' ' LEU . . . . . 0.474 ' O ' ' HG2' ' B' ' 428' ' ' GLN . 0.5 OUTLIER -79.56 -49.77 11.72 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 116.095 -0.502 . . . . 4.36 111.401 179.961 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.2 pp -61.46 -33.19 73.34 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.132 0.419 . . . . 3.21 112.132 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 427' ' ' PHE . . . . . 0.595 ' CZ ' HG23 ' A' ' 44' ' ' ILE . 1.4 t80 -61.84 -12.51 17.84 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.871 0.693 . . . . 5.27 112.871 -179.582 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 428' ' ' GLN . . . . . 0.474 ' HG2' ' O ' ' B' ' 425' ' ' LEU . 23.7 pt20 -67.7 -7.53 27.81 Favored 'General case' 0 C--O 1.235 0.314 0 O-C-N 122.216 -0.302 . . . . 5.32 111.51 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.654 -0.689 . . . . 5.11 110.511 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.523 ' HG2' ' O ' ' A' ' 17' ' ' VAL . 23.0 ptt? . . . . . 0 N--CA 1.476 0.859 0 CA-C-O 120.867 0.365 . . . . 1.65 110.492 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.498 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 65.3 mm-40 -87.01 142.4 27.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.935 0.398 . . . . 1.92 111.296 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 27.6 pt -127.58 162.51 32.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.862 -0.608 . . . . 1.48 109.874 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 68.5 m-85 -112.35 117.03 31.34 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.57 -0.287 . . . . 2.17 110.442 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.41 HG21 HD12 ' A' ' 15' ' ' LEU . 36.1 t -106.04 124.65 61.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.439 -0.346 . . . . 1.65 110.375 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -100.37 155.72 17.65 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.213 -0.449 . . . . 3.16 110.762 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.0 p -128.25 169.16 14.51 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.722 -0.844 . . . . 2.17 108.722 178.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 96.2 mt -71.29 -4.38 25.63 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.997 0.369 . . . . 3.05 111.997 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.92 11.75 38.07 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.002 0.43 . . . . 2.7 110.911 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.85 18.47 74.3 Favored Glycine 0 N--CA 1.451 -0.362 0 CA-C-N 115.935 -0.575 . . . . 2.64 112.786 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -95.15 127.0 40.86 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.643 0.259 . . . . 2.34 110.402 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.7 m -107.79 126.34 52.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.345 -0.389 . . . . 2.31 110.11 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.7 mt -116.48 144.76 23.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 116.289 -0.414 . . . . 1.83 110.432 -179.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.33 143.08 30.94 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.94 -0.393 . . . . 2.02 109.94 179.251 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.538 HD11 HG12 ' A' ' 30' ' ' ILE . 59.5 mt -138.96 143.12 38.43 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.702 0.287 . . . . 1.33 111.594 -179.632 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -97.32 108.79 21.59 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.987 -0.746 . . . . 2.4 108.987 178.567 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.523 ' O ' ' HG2' ' A' ' 1' ' ' MET . 4.6 m -135.34 168.58 22.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 116.471 -0.331 . . . . 1.25 110.749 -179.357 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.415 ' O ' HD12 ' A' ' 56' ' ' LEU . 61.1 mm-40 -127.69 159.46 65.99 Favored Pre-proline 0 C--N 1.319 -0.725 0 N-CA-C 109.316 -0.624 . . . . 1.85 109.316 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -52.55 -35.98 69.1 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.79 2.326 . . . . 1.78 112.806 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.56 3.36 22.04 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.74 0.644 . . . . 1.8 112.74 -179.06 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -79.88 138.22 37.11 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.907 -0.317 . . . . 1.23 111.146 -179.475 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.1 OUTLIER -86.74 147.91 25.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.049 -0.523 . . . . 1.44 110.488 -179.901 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 48.5 mm -56.78 -36.48 49.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-O 120.872 0.367 . . . . 0.99 110.655 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -58.26 -43.44 87.88 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.9 -0.591 . . . . 2.22 109.915 178.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -70.07 -35.83 74.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.74 -0.663 . . . . 1.23 110.323 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 22' ' ' THR . 98.2 t -62.54 -44.41 99.31 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 N-CA-C 109.646 -0.501 . . . . 0.64 109.646 179.123 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -63.21 -34.67 78.15 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.176 -0.466 . . . . 1.32 110.16 179.109 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.86 -34.79 78.95 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.054 -0.521 . . . . 1.08 109.627 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -68.76 -34.99 76.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.779 -0.646 . . . . 1.08 109.857 178.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.538 HG12 HD11 ' A' ' 15' ' ' LEU . 57.5 mt -72.56 -40.85 63.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 108.86 -0.793 . . . . 1.31 108.86 178.37 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -60.57 -37.05 80.04 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.599 -0.728 . . . . 1.93 110.626 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -65.13 -30.54 71.47 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.07 -0.514 . . . . 2.05 111.751 -179.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -93.12 -49.25 6.09 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 113.074 0.768 . . . . 2.17 113.074 -178.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 51.5 mm-40 -88.45 -19.34 26.64 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 113.4 0.889 . . . . 2.14 113.4 -177.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.28 24.37 77.04 Favored Glycine 0 N--CA 1.453 -0.202 0 C-N-CA 120.717 -0.754 . . . . 2.01 112.57 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 77.1 mt -99.03 129.82 28.77 Favored Pre-proline 0 C--N 1.327 -0.384 0 O-C-N 122.869 -0.195 . . . . 1.83 110.642 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -52.1 136.39 53.41 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 123.028 2.485 . . . . 2.04 112.493 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -64.84 -15.22 49.2 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.971 2.448 . . . . 1.52 112.902 -179.086 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -78.76 -26.91 44.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.996 0.427 . . . . 2.95 110.607 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -94.77 -11.15 29.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.215 0.531 . . . . 2.56 110.084 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -78.98 109.9 13.71 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.464 -0.789 . . . . 1.4 111.72 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.566 ' HB3' ' CE2' ' B' ' 427' ' ' PHE . 7.9 mmt180 -111.35 102.16 10.57 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.436 -0.579 . . . . 2.65 109.436 178.485 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.616 ' HB3' HD12 ' A' ' 50' ' ' LEU . 18.0 mt -88.64 135.21 33.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.157 -0.474 . . . . 1.02 111.759 -179.058 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.758 HD12 ' HB3' ' B' ' 401' ' ' LEU . 0.0 OUTLIER -129.89 150.16 34.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.846 -0.615 . . . . 2.14 110.673 179.571 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.554 ' HB2' HD21 ' A' ' 50' ' ' LEU . 29.6 t80 -133.48 96.04 3.63 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.654 -0.703 . . . . 1.71 109.144 178.446 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.68 39.81 20.65 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.795 -0.638 . . . . 2.1 111.867 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.23 -16.56 61.05 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.734 -0.746 . . . . 1.84 113.153 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 42.4 mtmt -93.11 114.57 27.13 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 122.821 -0.223 . . . . 3.05 111.157 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -68.35 136.36 53.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.269 -0.423 . . . . 2.3 110.365 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.616 HD12 ' HB3' ' A' ' 43' ' ' LEU . 18.6 mt -92.59 122.74 35.31 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.261 -0.427 . . . . 1.17 111.883 -178.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.7 ' HB2' ' HG2' ' A' ' 54' ' ' ARG . 30.3 mt-10 -80.13 150.02 30.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.1 -0.5 . . . . 2.65 110.475 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -65.54 -33.43 75.9 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.791 -0.64 . . . . 1.83 111.992 -178.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -85.2 17.09 34.89 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.995 -0.622 . . . . 1.82 114.353 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.7 ' HG2' ' HB2' ' A' ' 51' ' ' GLU . 20.3 mmt180 -117.11 165.24 13.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 117.285 0.542 . . . . 2.69 110.868 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 22' ' ' THR . 19.5 p -109.49 177.78 4.64 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.044 -0.525 . . . . 1.71 109.589 178.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.415 HD12 ' O ' ' A' ' 18' ' ' GLU . 75.9 mt -67.22 -36.68 82.2 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.836 0.35 . . . . 1.49 111.111 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.2 m -67.22 -21.76 65.74 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.326 -0.397 . . . . 1.94 111.561 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -67.67 -28.34 67.61 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.544 -0.298 . . . . 2.03 111.247 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -112.58 14.3 20.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.824 0.345 . . . . 1.76 111.058 -179.642 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 59.32 38.13 23.22 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.723 -0.672 . . . . 2.96 111.455 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 73.7 mt -84.39 107.76 15.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.015 -0.539 . . . . 1.65 109.848 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -101.46 -167.06 1.37 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.87 -0.605 . . . . 2.66 110.58 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.507 ' HB3' ' HB2' ' A' ' 1' ' ' MET . 56.3 pttt -72.4 144.5 48.16 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.693 0.282 . . . . 3.22 111.261 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 68.84 18.87 8.5 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.61 -0.723 . . . . 3.12 112.939 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 51.5 m -76.58 154.74 34.18 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.74 -0.467 . . . . 1.83 109.74 178.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.4 m -105.76 119.55 39.44 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.934 0.397 . . . . 2.03 111.099 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.4 mp -111.34 148.98 31.81 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.671 -0.695 . . . . 1.41 109.193 179.432 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -116.1 137.56 52.02 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 120.721 0.296 . . . . 2.76 111.188 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 33.4 tp -116.16 115.01 25.25 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.158 -0.474 . . . . 1.54 111.329 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.533 HG23 HD11 ' A' ' 44' ' ' ILE . 39.7 t -105.24 132.58 51.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.995 -0.548 . . . . 1.79 110.091 179.265 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 78.3 mt -91.26 109.55 20.82 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.448 -0.575 . . . . 2.43 109.448 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.545 ' HG3' ' HA ' ' B' ' 424' ' ' SER . 23.3 ttt180 -92.06 117.69 30.08 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.142 0.496 . . . . 3.19 111.159 -179.702 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.8 mt -89.01 155.89 19.2 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.689 -0.687 . . . . 2.99 110.3 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 74' ' ' ARG . 14.1 mmt180 -92.48 -7.12 48.32 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.27 0.557 . . . . 3.67 109.979 179.063 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -166.64 166.08 38.78 Favored Glycine 0 N--CA 1.442 -0.904 0 N-CA-C 110.626 -0.99 . . . . 3.08 110.626 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.154 -1.359 . . . . 3.82 111.24 -179.95 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.773 0 N-CA-C 111.963 -0.455 . . . . 5.66 111.963 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 3.6 m -85.1 64.82 8.9 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.209 0.528 . . . . 5.53 110.744 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -80.69 74.54 7.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.931 -0.577 . . . . 3.98 111.106 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.18 -7.37 57.0 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.13 0.491 . . . . 4.15 110.353 179.251 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 390' ' ' PHE . . . . . 0.719 ' HB2' HD11 ' B' ' 395' ' ' ILE . 0.1 OUTLIER -129.09 97.48 26.11 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 115.993 -0.548 . . . . 2.51 110.481 -179.677 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -64.83 147.63 89.59 Favored 'Trans proline' 0 C--O 1.235 0.361 0 C-N-CA 122.645 2.23 . . . . 3.77 111.349 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -49.86 -59.23 4.04 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 113.588 0.959 . . . . 5.36 113.588 -178.374 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 54.0 tt0 -48.91 -52.41 24.7 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.554 0.575 . . . . 6.89 112.554 -179.031 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 394' ' ' THR . . . . . 0.431 HG22 ' HB2' ' B' ' 419' ' ' ALA . 0.0 OUTLIER -56.09 -43.11 77.74 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.348 -0.387 . . . . 4.2 111.759 -179.467 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 395' ' ' ILE . . . . . 0.719 HD11 ' HB2' ' B' ' 390' ' ' PHE . 75.0 mt -66.16 -51.82 55.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.412 -0.358 . . . . 3.8 110.399 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -57.78 -40.38 79.7 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.961 -0.563 . . . . 6.27 112.099 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 397' ' ' GLN . . . . . 0.438 ' O ' ' HG ' ' B' ' 401' ' ' LEU . 28.1 mm-40 -63.72 -43.52 96.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.932 0.396 . . . . 6.91 110.703 179.244 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 398' ' ' LEU . . . . . 0.518 HD13 HG23 ' B' ' 408' ' ' VAL . 1.0 OUTLIER -73.98 -33.9 64.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.95 -0.568 . . . . 4.31 111.801 -179.462 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 399' ' ' MET . . . . . 0.47 ' HE1' ' HB ' ' B' ' 408' ' ' VAL . 30.3 mmt -67.12 -40.94 86.9 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.821 0.343 . . . . 5.8 111.269 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -63.76 -24.52 67.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 7.71 112.119 -178.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 401' ' ' LEU . . . . . 0.758 ' HB3' HD12 ' A' ' 44' ' ' ILE . 31.9 mt -63.29 -23.28 67.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.026 0.441 . . . . 5.69 110.879 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 109.78 42.23 1.24 Allowed Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 121.039 -0.6 . . . . 5.87 111.614 -179.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -129.49 153.46 80.65 Favored Pre-proline 0 C--N 1.325 -0.464 0 N-CA-C 110.527 -0.175 . . . . 4.83 110.527 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -83.82 160.07 14.05 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 122.724 2.283 . . . . 4.72 112.612 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.462 ' O ' HG12 ' B' ' 408' ' ' VAL . 23.7 ttt180 -61.04 -30.83 70.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.579 -0.737 . . . . 4.16 110.379 179.512 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -56.68 -43.91 80.91 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.563 -0.744 . . . . 4.69 110.714 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -71.82 -42.09 67.42 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.707 -0.679 . . . . 2.99 112.124 -179.081 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 408' ' ' VAL . . . . . 0.518 HG23 HD13 ' B' ' 398' ' ' LEU . 4.2 p -61.61 -37.3 77.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 111.989 0.366 . . . . 2.06 111.989 -179.131 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 71.9 t -68.94 -48.21 71.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.648 0.261 . . . . 2.89 110.79 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 82.5 mttt -61.3 -44.15 97.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.975 0.417 . . . . 5.05 111.167 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -66.0 -49.59 67.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.915 -0.584 . . . . 2.96 111.725 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 45.3 mt -62.49 -32.38 73.28 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.774 0.657 . . . . 3.45 112.774 -179.152 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 413' ' ' LYS . . . . . 0.452 ' HE2' ' CZ ' ' B' ' 390' ' ' PHE . 61.4 mmtt -69.18 -45.25 70.44 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.923 -0.311 . . . . 5.52 111.721 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 29.0 pt20 -75.28 -26.94 59.15 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.925 0.713 . . . . 5.53 112.925 -178.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 415' ' ' THR . . . . . 0.506 HG21 ' HA ' ' B' ' 422' ' ' ALA . 41.2 p -94.61 -3.28 49.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.084 0.469 . . . . 5.42 111.146 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 61.82 60.85 1.5 Allowed 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.563 0.949 . . . . 6.37 113.563 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 72.03 -24.16 0.7 Allowed Glycine 0 CA--C 1.522 0.5 0 N-CA-C 115.945 1.138 . . . . 4.33 115.945 177.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.37 103.09 2.32 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 122.0 0.905 . . . . 6.25 110.944 -179.543 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 419' ' ' ALA . . . . . 0.595 ' HA ' ' HB3' ' B' ' 422' ' ' ALA . . . -66.24 -20.66 66.18 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 115.023 -0.989 . . . . 4.12 112.69 -178.231 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -61.69 -50.33 72.9 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.481 0.658 . . . . 6.99 109.305 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -80.46 -27.11 37.96 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.546 -0.752 . . . . 7.48 109.823 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 422' ' ' ALA . . . . . 0.595 ' HB3' ' HA ' ' B' ' 419' ' ' ALA . . . -61.35 -48.09 82.88 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 110.02 -0.363 . . . . 3.68 110.02 178.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.418 ' O ' ' HB2' ' B' ' 427' ' ' PHE . . . -65.68 -40.51 92.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.854 -0.612 . . . . 3.8 109.685 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 424' ' ' SER . . . . . 0.545 ' HA ' ' HG3' ' A' ' 72' ' ' ARG . 21.6 m -61.41 -39.39 90.56 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.749 -0.659 . . . . 5.05 111.069 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.69 -46.84 23.99 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.291 -0.413 . . . . 4.36 110.979 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.3 -37.06 76.77 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.988 0.366 . . . . 3.21 111.988 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 427' ' ' PHE . . . . . 0.566 ' CE2' ' HB3' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -77.25 3.15 13.58 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 113.621 0.971 . . . . 5.27 113.621 -178.683 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 29.2 pt20 -56.94 -20.98 26.54 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.251 0.463 . . . . 5.32 112.251 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 14.2 m . . . . . 0 C--O 1.251 1.134 0 CA-C-O 118.61 -0.709 . . . . 5.11 111.328 -179.777 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.456 ' HG2' ' O ' ' A' ' 17' ' ' VAL . 20.8 ptt? . . . . . 0 N--CA 1.481 1.094 0 CA-C-O 120.577 0.227 . . . . 1.65 110.423 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -109.28 138.17 46.04 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 111.967 0.358 . . . . 1.92 111.967 -179.341 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 16.0 pt -130.32 159.38 42.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.779 -0.646 . . . . 1.48 109.534 178.285 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -121.03 123.65 42.91 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.75 0.309 . . . . 2.17 110.574 -179.417 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.4 t -105.42 127.22 60.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.451 -0.34 . . . . 1.65 111.008 -179.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.1 mmtp -92.65 128.3 38.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.282 -0.417 . . . . 3.16 110.829 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.436 HG23 HD23 ' A' ' 69' ' ' LEU . 0.2 OUTLIER -105.06 164.76 11.56 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.224 -0.444 . . . . 2.17 110.751 179.796 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.402 ' HA ' HD23 ' A' ' 8' ' ' LEU . 10.5 mt -64.12 -15.56 59.95 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.413 0.523 . . . . 3.05 112.413 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -90.79 5.23 49.19 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.936 0.398 . . . . 2.7 110.632 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.13 3.97 90.58 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.858 -0.687 . . . . 2.64 111.416 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -75.11 148.41 39.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.413 -0.393 . . . . 2.34 111.037 -179.507 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.9 m -119.3 108.19 14.31 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.802 -0.814 . . . . 2.31 108.802 178.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 17.9 mt -92.49 126.51 44.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.33 -0.396 . . . . 1.83 111.466 -178.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.0 122.6 34.66 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.196 -0.668 . . . . 2.02 109.196 178.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 76.2 mt -122.25 137.94 54.66 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 112.429 0.529 . . . . 1.33 112.429 -178.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -90.78 108.5 19.87 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.259 -1.015 . . . . 2.4 108.259 178.432 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.456 ' O ' ' HG2' ' A' ' 1' ' ' MET . 10.9 m -139.49 173.82 10.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.048 0.451 . . . . 1.25 111.056 -178.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 36.5 mm-40 -138.93 157.31 71.8 Favored Pre-proline 0 C--N 1.32 -0.708 0 N-CA-C 107.923 -1.14 . . . . 1.85 107.923 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.772 ' HA ' ' HB2' ' A' ' 56' ' ' LEU . 88.2 Cg_exo -50.1 -33.04 33.73 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.749 2.299 . . . . 1.78 112.883 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.5 m -74.36 -10.17 59.32 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.799 0.666 . . . . 1.8 112.799 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -77.33 135.46 38.38 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.85 -0.426 . . . . 1.23 109.85 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -86.16 150.12 24.63 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.538 -0.301 . . . . 1.44 110.945 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.421 HG13 ' HB3' ' A' ' 50' ' ' LEU . 43.5 mm -55.66 -36.06 41.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-O 121.033 0.444 . . . . 0.99 110.427 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.447 ' HB2' ' HB3' ' A' ' 52' ' ' ASP . 20.4 tt0 -59.42 -41.37 89.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.581 -0.736 . . . . 2.22 110.695 179.417 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -71.6 -34.84 70.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.032 -0.531 . . . . 1.23 110.679 -179.568 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.8 t -60.62 -42.61 92.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.069 -0.514 . . . . 0.64 109.725 179.004 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.522 ' HG2' HD12 ' A' ' 43' ' ' LEU . 37.2 mtmt -62.74 -36.39 82.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.926 -0.579 . . . . 1.32 110.63 179.37 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.45 -35.54 80.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.985 -0.552 . . . . 1.08 110.55 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -67.74 -37.34 82.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.018 -0.537 . . . . 1.08 109.909 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 54.2 mt -70.99 -33.05 50.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.027 -0.533 . . . . 1.31 110.196 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.741 ' HG3' ' HD3' ' A' ' 38' ' ' PRO . 1.7 tt0 -64.84 -34.6 78.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.943 -0.571 . . . . 1.93 110.803 179.69 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -81.18 -36.2 30.45 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.291 -0.413 . . . . 2.05 111.157 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 75.6 mttt -76.48 -55.38 5.58 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.399 0.518 . . . . 2.17 112.399 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 55.7 mm-40 -85.74 -42.29 14.35 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.118 0.414 . . . . 2.14 112.118 -178.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 105.55 8.05 35.81 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.614 -0.803 . . . . 2.01 111.361 -179.097 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 24.9 mt -89.58 121.09 69.5 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.73 -0.47 . . . . 1.83 109.73 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.463 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 55.1 Cg_exo -54.39 135.32 65.26 Favored 'Trans proline' 0 C--N 1.342 0.231 0 C-N-CA 122.907 2.405 . . . . 2.04 111.409 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.741 ' HD3' ' HG3' ' A' ' 31' ' ' GLN . 32.2 Cg_exo -59.23 -22.39 64.65 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 123.302 2.668 . . . . 1.52 112.373 -179.045 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -77.4 -23.21 50.7 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.928 -0.578 . . . . 2.95 110.882 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -102.56 7.74 40.0 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.119 0.485 . . . . 2.56 110.634 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -91.34 176.16 6.66 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.472 -0.785 . . . . 1.4 110.475 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.458 ' O ' ' HA ' ' A' ' 69' ' ' LEU . 0.0 OUTLIER -160.37 94.51 1.08 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.85 -0.796 . . . . 2.65 108.85 179.38 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.522 HD12 ' HG2' ' A' ' 27' ' ' LYS . 16.8 mt -100.18 123.19 44.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.094 0.473 . . . . 1.02 112.263 -178.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.667 HG22 ' HA ' ' A' ' 49' ' ' GLN . 20.0 pt -132.78 163.07 38.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.706 -0.679 . . . . 2.14 109.687 178.285 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.45 ' CB ' HD21 ' A' ' 50' ' ' LEU . 74.7 t80 -130.09 112.74 13.72 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.465 -0.334 . . . . 1.71 110.281 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.58 35.11 22.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.791 -0.641 . . . . 2.1 111.98 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.3 -17.67 56.57 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.771 -0.728 . . . . 1.84 113.249 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -95.39 126.27 40.58 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.112 -0.329 . . . . 3.05 110.112 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.667 ' HA ' HG22 ' A' ' 44' ' ' ILE . 0.9 OUTLIER -67.14 151.08 48.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.054 0.454 . . . . 2.3 111.705 -178.977 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.45 HD21 ' CB ' ' A' ' 45' ' ' PHE . 18.9 mt -108.64 132.52 53.82 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.574 -0.739 . . . . 1.17 110.206 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.783 ' HB2' ' HG2' ' A' ' 54' ' ' ARG . 46.9 mt-10 -86.85 146.78 26.08 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.401 -0.363 . . . . 2.65 110.667 179.462 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.447 ' HB3' ' HB2' ' A' ' 24' ' ' GLU . 9.0 m-20 -61.76 -34.76 76.43 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 112.713 0.634 . . . . 1.83 112.713 -178.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -85.12 14.23 50.56 Favored Glycine 0 N--CA 1.453 -0.217 0 C-N-CA 120.962 -0.637 . . . . 1.82 113.043 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.783 ' HG2' ' HB2' ' A' ' 51' ' ' GLU . 30.1 mmt180 -112.45 152.0 29.23 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.027 0.441 . . . . 2.69 110.456 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.501 ' HB ' ' O ' ' A' ' 19' ' ' PRO . 68.4 p -99.19 175.26 5.95 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 108.891 -0.781 . . . . 1.71 108.891 179.232 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.772 ' HB2' ' HA ' ' A' ' 19' ' ' PRO . 88.0 mt -68.93 -31.54 70.5 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.357 -0.608 . . . . 1.49 109.357 178.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.89 -28.53 68.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.555 -0.748 . . . . 1.94 110.632 178.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' A' ' 55' ' ' THR . 2.4 m-20 -60.34 -32.41 71.23 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.112 -0.495 . . . . 2.03 111.118 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -108.82 12.0 25.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.233 -0.44 . . . . 1.76 111.58 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 61.4 30.21 18.85 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.911 -0.586 . . . . 2.96 111.707 -179.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.453 ' HB ' ' HB3' ' A' ' 56' ' ' LEU . 86.4 mt -74.42 116.59 17.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 109.375 -0.602 . . . . 1.65 109.375 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -109.5 -163.24 0.85 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.953 -0.567 . . . . 2.66 110.306 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.9 pttt -73.86 149.43 41.56 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.677 -0.238 . . . . 3.22 110.815 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 69.41 19.15 7.72 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.711 0.634 . . . . 3.12 112.711 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.417 ' HB3' ' HE1' ' A' ' 45' ' ' PHE . 20.3 m -82.3 146.76 29.26 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.784 0.326 . . . . 1.83 110.328 179.265 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 10.3 m -105.33 120.9 42.72 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.045 0.45 . . . . 2.03 111.539 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.5 mp -102.62 147.27 27.0 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.7 -0.682 . . . . 1.41 109.461 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.57 ' HB2' ' CG1' ' A' ' 44' ' ' ILE . 23.9 m80 -105.57 129.78 53.76 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.579 -0.282 . . . . 2.76 110.936 -179.204 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.458 ' HA ' ' O ' ' A' ' 42' ' ' ARG . 29.1 tp -123.4 121.86 36.82 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.254 -0.43 . . . . 1.54 110.781 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.651 HG22 ' HB1' ' B' ' 423' ' ' ALA . 0.5 OUTLIER -116.88 153.41 18.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.311 -0.404 . . . . 1.79 110.917 179.612 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 95.9 mt -85.89 131.23 34.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.077 0.465 . . . . 2.43 111.203 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.561 ' HA ' ' HB3' ' B' ' 424' ' ' SER . 12.1 ttt180 -106.16 80.01 1.46 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.858 -0.61 . . . . 3.19 109.501 178.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.622 HD11 ' HB3' ' B' ' 420' ' ' GLU . 77.6 mt -63.18 150.06 43.86 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.726 -0.67 . . . . 2.99 111.417 -179.503 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 74' ' ' ARG . 14.5 mmt85 -103.36 -63.25 1.2 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.072 -0.513 . . . . 3.67 110.087 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -114.77 146.35 18.77 Favored Glycine 0 N--CA 1.445 -0.746 0 N-CA-C 111.107 -0.797 . . . . 3.08 111.107 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.152 0 CA-C-O 118.754 -1.026 . . . . 3.82 111.869 -179.701 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.654 0 N-CA-C 111.271 -0.732 . . . . 5.66 111.271 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 1.9 m -71.76 94.66 1.41 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.063 0.458 . . . . 5.53 110.147 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -118.89 32.81 5.94 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.884 -0.598 . . . . 3.98 110.635 -179.164 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.12 -25.27 68.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.631 -0.713 . . . . 4.15 110.607 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 390' ' ' PHE . . . . . 0.768 ' HB3' HD11 ' B' ' 395' ' ' ILE . 57.4 m-85 -109.92 113.42 57.25 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 115.754 -0.657 . . . . 2.51 110.228 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_exo -72.67 121.09 7.1 Favored 'Trans proline' 0 C--O 1.235 0.347 0 C-N-CA 123.054 2.503 . . . . 3.77 111.968 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 392' ' ' GLU . . . . . 0.634 ' HB3' ' HE3' ' B' ' 396' ' ' LYS . 18.4 mt-10 -51.19 -50.34 59.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.873 -0.603 . . . . 5.36 112.514 -179.366 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -55.16 -50.12 70.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.025 -0.534 . . . . 6.89 111.918 -179.082 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 2.1 m -61.18 -45.18 95.67 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.032 -0.531 . . . . 4.2 111.29 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 395' ' ' ILE . . . . . 0.768 HD11 ' HB3' ' B' ' 390' ' ' PHE . 75.0 mt -60.64 -48.71 87.48 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.109 0 CA-C-O 120.662 0.268 . . . . 3.8 110.848 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 396' ' ' LYS . . . . . 0.634 ' HE3' ' HB3' ' B' ' 392' ' ' GLU . 73.3 mttt -58.28 -41.27 84.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 6.27 111.925 -179.461 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -68.33 -36.8 79.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.841 0.353 . . . . 6.91 110.723 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 83.4 mt -68.43 -24.28 64.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.285 -0.416 . . . . 4.31 111.051 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 399' ' ' MET . . . . . 0.615 ' HG2' ' O ' ' B' ' 395' ' ' ILE . 23.1 mmt -68.36 -25.11 64.92 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.04 0.448 . . . . 5.8 110.63 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -73.96 -11.43 60.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.886 -0.597 . . . . 7.71 111.416 -179.353 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 74.9 mt -86.03 16.96 3.79 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.035 0.383 . . . . 5.69 112.035 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 62.53 47.3 90.36 Favored Glycine 0 CA--C 1.518 0.227 0 C-N-CA 121.07 -0.586 . . . . 5.87 112.589 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -134.51 150.3 73.36 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-O 120.361 0.124 . . . . 4.83 110.802 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 404' ' ' PRO . . . . . 0.466 ' HG2' ' HB2' ' B' ' 407' ' ' ALA . 52.4 Cg_endo -69.49 153.35 70.29 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.955 2.437 . . . . 4.72 112.204 179.557 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.467 ' HA ' ' HE3' ' B' ' 399' ' ' MET . 25.9 ttt180 -68.76 -41.0 79.47 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.123 0.416 . . . . 4.16 112.123 -178.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -59.6 -37.31 78.24 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.405 -0.361 . . . . 4.69 111.527 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 407' ' ' ALA . . . . . 0.466 ' HB2' ' HG2' ' B' ' 404' ' ' PRO . . . -61.72 -39.38 91.3 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.244 -0.434 . . . . 2.99 110.518 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 55.2 t -66.09 -40.75 88.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.85 -0.614 . . . . 2.06 110.11 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 88.6 t -60.24 -46.01 95.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.033 -0.531 . . . . 2.89 110.189 179.099 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 19.2 mttp -67.69 -39.3 84.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.984 -0.553 . . . . 5.05 111.155 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -65.81 -49.2 69.12 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.181 -0.463 . . . . 2.96 111.309 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 46.5 mt -63.63 -30.7 71.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.452 -0.34 . . . . 3.45 111.375 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -64.66 -49.06 72.48 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.32 -0.4 . . . . 5.52 111.041 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -80.05 -9.73 59.72 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.207 0.817 . . . . 5.53 113.207 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 31.4 p -107.75 -4.99 17.59 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.759 0.314 . . . . 5.42 110.96 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 55.1 m-80 64.91 55.4 1.19 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.857 -0.611 . . . . 6.37 112.501 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 72.71 -6.94 10.05 Favored Glycine 0 CA--C 1.519 0.287 0 CA-C-N 115.864 -0.607 . . . . 4.33 114.253 178.625 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -67.8 93.99 0.43 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.018 0.437 . . . . 6.25 110.15 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -59.08 -35.88 74.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.527 -0.76 . . . . 4.12 112.287 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 420' ' ' GLU . . . . . 0.622 ' HB3' HD11 ' A' ' 73' ' ' LEU . 12.7 mt-10 -71.94 -43.79 64.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.883 0.373 . . . . 6.99 110.674 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -67.78 -39.68 84.04 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.189 -0.46 . . . . 7.48 109.861 179.582 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -61.73 -38.99 89.99 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.779 -0.646 . . . . 3.68 110.436 179.446 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.651 ' HB1' HG22 ' A' ' 70' ' ' VAL . . . -57.3 -48.8 77.99 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.009 -0.541 . . . . 3.8 110.613 179.445 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 424' ' ' SER . . . . . 0.561 ' HB3' ' HA ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -63.12 -30.88 71.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.053 -0.521 . . . . 5.05 111.612 179.123 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 425' ' ' LEU . . . . . 0.598 ' O ' ' HG2' ' B' ' 428' ' ' GLN . 3.4 mm? -81.82 -50.25 9.44 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 113.747 1.017 . . . . 4.36 113.747 -178.556 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.3 pp -62.63 -34.25 76.66 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.126 0.788 . . . . 3.21 113.126 -178.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 427' ' ' PHE . . . . . 0.442 ' HD2' ' HG2' ' A' ' 42' ' ' ARG . 2.0 m-85 -67.04 -13.03 61.52 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.341 0.867 . . . . 5.27 113.341 -179.467 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 428' ' ' GLN . . . . . 0.598 ' HG2' ' O ' ' B' ' 425' ' ' LEU . 3.2 pt20 -77.39 -18.63 57.15 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 120.809 -0.356 . . . . 5.32 111.811 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 6.6 m . . . . . 0 C--O 1.247 0.954 0 CA-C-O 118.676 -0.678 . . . . 5.11 110.9 -179.372 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.5 ' HB2' ' HB3' ' A' ' 63' ' ' LYS . 26.0 ptt? . . . . . 0 N--CA 1.481 1.099 0 N-CA-C 110.204 -0.295 . . . . 1.65 110.204 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.858 HE22 ' HG2' ' A' ' 16' ' ' GLU . 89.2 mm-40 -102.27 135.33 44.06 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.914 0.388 . . . . 1.92 111.582 -179.42 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.3 pt -126.63 151.93 33.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.027 -0.533 . . . . 1.48 109.916 178.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -108.93 124.75 51.16 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.673 -0.239 . . . . 2.17 111.167 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.1 t -111.8 118.83 58.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.42 -0.585 . . . . 1.65 109.42 179.109 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -102.09 132.68 47.81 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.0 0.429 . . . . 3.16 111.727 -179.015 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.404 ' OG1' ' HB3' ' A' ' 11' ' ' LYS . 26.5 p -99.06 175.85 5.77 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.959 -0.564 . . . . 2.17 110.224 179.728 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.476 HD21 HG22 ' A' ' 70' ' ' VAL . 92.8 mt -79.28 10.61 3.52 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.914 0.388 . . . . 3.05 111.7 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -110.04 3.52 20.43 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.318 -0.401 . . . . 2.7 110.71 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 80.18 24.88 58.62 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.796 -0.716 . . . . 2.64 111.783 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.662 ' HE2' HG12 ' A' ' 13' ' ' ILE . 81.5 tttt -106.35 134.88 48.79 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.584 0.23 . . . . 2.34 110.499 -179.616 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.1 m -115.64 109.48 17.81 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.961 0.41 . . . . 2.31 110.755 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.662 HG12 ' HE2' ' A' ' 11' ' ' LYS . 7.5 mt -95.26 138.48 20.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.893 -0.594 . . . . 1.83 110.428 -179.499 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.5 m -101.94 115.09 29.78 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.761 -0.459 . . . . 2.02 109.761 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.434 HD11 HG12 ' A' ' 30' ' ' ILE . 55.1 mt -105.07 143.32 33.41 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.059 0.456 . . . . 1.33 112.124 -179.078 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.858 ' HG2' HE22 ' A' ' 2' ' ' GLN . 14.9 mt-10 -98.97 101.51 12.93 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.46 -0.791 . . . . 2.4 109.609 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 16.3 m -138.2 -179.0 2.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.991 -0.549 . . . . 1.25 110.821 -178.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.418 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 27.4 mm-40 -132.78 157.72 77.62 Favored Pre-proline 0 C--N 1.323 -0.584 0 N-CA-C 109.035 -0.728 . . . . 1.85 109.035 179.098 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.583 ' HA ' ' HB2' ' A' ' 56' ' ' LEU . 74.6 Cg_exo -53.34 -29.67 48.95 Favored 'Trans proline' 0 CA--C 1.533 0.467 0 C-N-CA 122.882 2.388 . . . . 1.78 113.058 -179.638 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.98 -5.48 48.8 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.14 0.422 . . . . 1.8 112.14 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.418 ' HB2' ' O ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -74.07 144.04 45.18 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.029 0.442 . . . . 1.23 110.757 -179.693 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -93.48 145.13 24.73 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.798 -0.637 . . . . 1.44 110.075 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.559 HG23 HD12 ' A' ' 43' ' ' LEU . 46.1 mm -53.34 -42.77 49.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 O-C-N 123.166 0.291 . . . . 0.99 111.469 -179.681 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -56.59 -44.34 80.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.366 -0.379 . . . . 2.22 110.7 179.431 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.483 ' O ' ' HG3' ' A' ' 29' ' ' LYS . 66.5 t30 -67.27 -37.31 83.26 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.961 -0.563 . . . . 1.23 110.667 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 87.2 t -61.37 -43.49 96.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.086 -0.506 . . . . 0.64 110.462 179.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.8 mtmt -63.33 -34.17 77.12 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.209 -0.451 . . . . 1.32 110.976 179.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -64.96 -32.81 74.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.086 -0.506 . . . . 1.08 110.132 179.233 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 21.4 mttt -71.04 -37.43 72.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.009 -0.542 . . . . 1.08 109.827 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.434 HG12 HD11 ' A' ' 15' ' ' LEU . 59.3 mt -66.77 -38.23 81.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 109.084 -0.71 . . . . 1.31 109.084 178.826 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -65.63 -37.34 86.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.753 -0.658 . . . . 1.93 110.596 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -67.72 -37.17 81.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.219 -0.446 . . . . 2.05 112.019 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -87.3 -54.48 4.28 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 113.046 0.758 . . . . 2.17 113.046 -178.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -77.36 -35.85 54.16 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.702 0.63 . . . . 2.14 112.702 -178.266 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 91.57 13.77 57.83 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.454 -0.879 . . . . 2.01 111.835 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.0 mt -95.17 123.77 56.01 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 110.075 -0.343 . . . . 1.83 110.075 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -52.98 137.81 61.84 Favored 'Trans proline' 0 CA--C 1.532 0.378 0 C-N-CA 123.083 2.522 . . . . 2.04 112.33 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -62.57 -18.7 64.99 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.943 2.429 . . . . 1.52 111.974 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -71.13 -25.4 62.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.953 -0.567 . . . . 2.95 110.238 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -102.15 6.65 40.91 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.043 -0.526 . . . . 2.56 110.368 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.507 ' HB3' HD11 ' A' ' 69' ' ' LEU . 75.5 mt-30 -98.6 114.95 27.61 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.924 -0.58 . . . . 1.4 111.661 -179.152 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.418 ' HD2' ' HB2' ' A' ' 72' ' ' ARG . 66.6 mtp180 -116.59 101.59 8.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.241 -0.436 . . . . 2.65 109.979 178.318 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.559 HD12 HG23 ' A' ' 23' ' ' ILE . 21.7 mt -77.33 128.26 33.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.894 0.378 . . . . 1.02 111.26 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.436 HD13 ' HZ ' ' B' ' 403' ' ' PHE . 53.5 mt -124.88 137.63 56.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.669 -0.696 . . . . 2.14 110.772 -179.498 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.48 ' HB3' HD21 ' A' ' 50' ' ' LEU . 40.4 t80 -132.7 113.22 12.73 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.038 -0.727 . . . . 1.71 109.038 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 63.16 30.36 16.01 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.22 -0.446 . . . . 2.1 112.01 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 86.04 4.06 84.7 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.871 -0.681 . . . . 1.84 113.089 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 41.6 mtmt -116.49 136.75 52.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.766 0.283 . . . . 3.05 110.906 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.571 ' HB2' ' CZ ' ' B' ' 427' ' ' PHE . 8.1 tt0 -73.6 145.87 45.1 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.199 -0.455 . . . . 2.3 110.529 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.48 HD21 ' HB3' ' A' ' 45' ' ' PHE . 26.1 mt -105.33 140.4 38.52 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.297 -0.41 . . . . 1.17 110.594 179.784 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.59 ' HB2' ' CG ' ' A' ' 54' ' ' ARG . 43.5 mt-10 -80.47 138.41 36.57 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.715 -0.476 . . . . 2.65 109.715 179.199 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.457 ' HA ' ' HB ' ' A' ' 23' ' ' ILE . 71.0 m-20 -64.77 -28.37 69.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.948 0.404 . . . . 1.83 111.06 -179.496 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -86.37 22.85 11.23 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 115.82 -0.627 . . . . 1.82 112.808 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.59 ' CG ' ' HB2' ' A' ' 51' ' ' GLU . 37.0 mmt180 -120.86 160.83 22.62 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.911 -0.403 . . . . 2.69 109.911 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.517 ' O ' ' HB2' ' A' ' 58' ' ' ASP . 35.2 p -103.8 174.44 5.87 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.922 -0.399 . . . . 1.71 109.922 179.287 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.583 ' HB2' ' HA ' ' A' ' 19' ' ' PRO . 85.8 mt -66.86 -35.99 81.31 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.168 0.508 . . . . 1.49 110.346 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.4 m -65.88 -21.85 66.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.828 -0.624 . . . . 1.94 110.339 178.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.517 ' HB2' ' O ' ' A' ' 55' ' ' THR . 4.7 m-20 -68.14 -21.51 64.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.784 -0.644 . . . . 2.03 112.158 -179.431 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -120.98 16.48 11.7 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.705 0.288 . . . . 1.76 111.271 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 60.99 28.71 18.49 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.729 -0.669 . . . . 2.96 111.617 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 67.2 mt -78.76 114.53 19.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.212 -0.449 . . . . 1.65 110.658 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -107.92 -165.99 1.1 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.753 -0.658 . . . . 2.66 110.117 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.709 ' HD2' ' HG3' ' A' ' 64' ' ' GLU . 0.1 OUTLIER -73.77 152.57 40.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.695 -0.23 . . . . 3.22 110.985 -179.905 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.709 ' HG3' ' HD2' ' A' ' 63' ' ' LYS . 46.6 mt-10 73.16 1.7 4.1 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 112.688 0.625 . . . . 3.12 112.688 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.0 m -74.06 146.24 43.83 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.755 0.312 . . . . 1.83 110.963 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.0 m -108.93 129.13 55.42 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.814 0.34 . . . . 2.03 111.192 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.2 mp -115.97 152.44 33.49 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.81 -0.811 . . . . 1.41 108.81 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 70.5 m80 -111.04 150.54 29.19 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.645 0.259 . . . . 2.76 111.193 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.507 HD11 ' HB3' ' A' ' 41' ' ' GLN . 23.2 tp -129.84 109.79 11.21 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.314 -0.403 . . . . 1.54 111.245 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.476 HG22 HD21 ' A' ' 8' ' ' LEU . 16.0 t -96.18 126.87 48.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 109.901 -0.407 . . . . 1.79 109.901 179.016 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 63.9 mt -74.46 112.34 10.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.947 -0.57 . . . . 2.43 109.903 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.432 ' HA ' ' OG ' ' B' ' 424' ' ' SER . 29.3 ttt180 -85.37 103.25 14.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.119 -0.491 . . . . 3.19 111.236 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 77.9 mt -73.77 126.25 29.95 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.007 -0.542 . . . . 2.99 109.796 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 74' ' ' ARG . 11.3 mmt180 -89.39 -32.25 17.37 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.89 0.376 . . . . 3.67 111.398 -179.23 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -134.06 131.95 6.2 Favored Glycine 0 N--CA 1.446 -0.691 0 C-N-CA 120.886 -0.673 . . . . 3.08 112.028 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.706 0 CA-C-O 118.848 -0.973 . . . . 3.82 111.532 179.84 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.67 0 N-CA-C 111.495 -0.642 . . . . 5.66 111.495 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 4.2 m -77.76 70.5 4.14 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.437 0.637 . . . . 5.53 110.715 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -86.34 85.73 7.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.709 -0.678 . . . . 3.98 110.272 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 5.4 m -63.04 -40.54 98.04 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.706 -0.679 . . . . 4.15 111.193 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 390' ' ' PHE . . . . . 0.619 ' HB3' ' HG ' ' B' ' 412' ' ' LEU . 0.1 OUTLIER -109.27 108.35 60.18 Favored Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 115.93 -0.577 . . . . 2.51 110.884 -179.354 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -64.77 141.56 72.5 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.656 2.237 . . . . 3.77 111.137 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 392' ' ' GLU . . . . . 0.61 ' O ' ' HG2' ' B' ' 396' ' ' LYS . 2.9 mm-40 -53.96 -41.08 67.41 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.605 0.594 . . . . 5.36 112.605 -179.187 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 42.4 tt0 -55.37 -52.58 63.07 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.932 0.396 . . . . 6.89 111.72 -179.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.44 -36.67 83.15 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.195 -0.457 . . . . 4.2 110.974 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 395' ' ' ILE . . . . . 0.45 ' O ' ' HG2' ' B' ' 399' ' ' MET . 93.1 mt -63.17 -42.37 96.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.075 -0.512 . . . . 3.8 110.317 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 396' ' ' LYS . . . . . 0.61 ' HG2' ' O ' ' B' ' 392' ' ' GLU . 24.1 mmtp -58.61 -41.2 85.31 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.481 -0.327 . . . . 6.27 110.913 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -63.48 -41.71 98.57 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.151 -0.477 . . . . 6.91 110.794 179.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 77.8 mt -73.44 -27.92 61.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.056 -0.52 . . . . 4.31 111.646 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 399' ' ' MET . . . . . 0.45 ' HG2' ' O ' ' B' ' 395' ' ' ILE . 31.4 mmt -67.62 -41.9 83.22 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.425 -0.352 . . . . 5.8 111.17 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -61.51 -24.39 66.57 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.118 -0.492 . . . . 7.71 111.699 -179.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 44.9 mt -68.93 -17.5 63.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 5.69 111.0 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 90.93 34.66 7.56 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.719 -0.753 . . . . 5.87 112.36 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 403' ' ' PHE . . . . . 0.436 ' HZ ' HD13 ' A' ' 44' ' ' ILE . 21.2 m-85 -113.8 149.88 42.5 Favored Pre-proline 0 C--N 1.325 -0.47 0 N-CA-C 110.531 -0.174 . . . . 4.83 110.531 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -67.03 142.62 62.46 Favored 'Trans proline' 0 CA--C 1.531 0.329 0 C-N-CA 122.474 2.116 . . . . 4.72 111.9 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -65.35 -33.81 76.83 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.394 -0.366 . . . . 4.16 111.447 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -62.56 -38.69 91.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.266 -0.424 . . . . 4.69 110.764 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -65.34 -33.94 77.14 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.163 0.506 . . . . 2.99 109.678 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 54.0 t -63.99 -41.73 93.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.347 -0.842 . . . . 2.06 109.432 179.081 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 409' ' ' VAL . . . . . 0.477 HG13 ' CZ ' ' B' ' 390' ' ' PHE . 88.0 t -59.93 -47.57 91.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.916 -0.584 . . . . 2.89 110.276 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 34.3 mttp -60.3 -47.5 85.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.663 -0.698 . . . . 5.05 111.079 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -67.18 -44.91 78.5 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.746 -0.661 . . . . 2.96 111.96 -178.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.619 ' HG ' ' HB3' ' B' ' 390' ' ' PHE . 2.6 mm? -63.93 -31.26 72.39 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.94 0.348 . . . . 3.45 111.94 -179.359 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 413' ' ' LYS . . . . . 0.413 ' HA ' ' HD3' ' B' ' 413' ' ' LYS . 32.3 mmtt -71.58 -45.91 60.85 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.801 0.297 . . . . 5.52 111.801 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -72.05 -27.82 62.94 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.196 0.443 . . . . 5.53 112.196 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 415' ' ' THR . . . . . 0.778 ' HB ' ' HB2' ' B' ' 418' ' ' ASN . 39.5 p -92.4 -14.48 28.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.816 0.341 . . . . 5.42 111.238 -179.897 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 59.81 62.42 1.69 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 113.039 0.755 . . . . 6.37 113.039 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 86.33 -12.21 61.25 Favored Glycine 0 CA--C 1.518 0.248 0 C-N-CA 120.523 -0.846 . . . . 4.33 114.051 178.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 418' ' ' ASN . . . . . 0.778 ' HB2' ' HB ' ' B' ' 415' ' ' THR . 33.4 m-80 -73.43 79.76 1.4 Allowed 'General case' 0 C--N 1.321 -0.668 0 O-C-N 122.348 -0.501 . . . . 6.25 110.117 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -58.62 -42.32 87.95 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.155 -0.475 . . . . 4.12 112.135 -179.012 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -65.11 -37.71 88.33 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.295 0.569 . . . . 6.99 110.542 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -73.34 -38.16 65.86 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.659 -0.7 . . . . 7.48 109.163 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -61.88 -42.65 99.31 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.549 -0.751 . . . . 3.68 110.408 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -58.93 -42.11 88.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.129 0.49 . . . . 3.8 110.09 179.095 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 424' ' ' SER . . . . . 0.432 ' OG ' ' HA ' ' A' ' 72' ' ' ARG . 71.6 m -70.49 -37.86 74.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.85 -0.614 . . . . 5.05 110.867 179.15 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -71.38 -48.85 47.44 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 113.058 0.762 . . . . 4.36 113.058 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.6 pp -67.3 -34.51 77.52 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.154 0.427 . . . . 3.21 112.154 -178.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 427' ' ' PHE . . . . . 0.571 ' CZ ' ' HB2' ' A' ' 49' ' ' GLN . 3.4 t80 -89.08 1.62 55.31 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.216 0.45 . . . . 5.27 112.216 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -59.9 -19.67 52.9 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.842 0.353 . . . . 5.32 111.698 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 41.0 m . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.244 -0.884 . . . . 5.11 109.981 179.237 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.403 ' HB2' ' HB3' ' A' ' 63' ' ' LYS . 25.0 ptt? . . . . . 0 N--CA 1.483 1.183 0 N-CA-C 110.092 -0.336 . . . . 1.65 110.092 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 77.1 mm-40 -107.42 138.68 43.18 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.659 0.266 . . . . 1.92 110.71 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 32.3 pt -124.15 163.64 23.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.439 -0.346 . . . . 1.48 110.092 179.095 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -117.65 122.79 44.52 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.787 0.327 . . . . 2.17 110.914 -179.593 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 56.1 t -106.74 122.39 60.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.287 -0.415 . . . . 1.65 109.988 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -109.52 137.33 47.52 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.197 0.523 . . . . 3.16 111.395 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.27 159.08 16.91 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.675 -0.693 . . . . 2.17 109.554 179.298 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.471 HD21 HD11 ' B' ' 401' ' ' LEU . 55.8 mt -64.57 -6.84 8.4 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.112 0.412 . . . . 3.05 112.112 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.9 p -88.96 -10.52 47.43 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.058 0.456 . . . . 2.7 110.338 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.47 -9.02 52.78 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.97 -0.559 . . . . 2.64 112.19 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -68.18 143.6 55.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.873 0.368 . . . . 2.34 111.514 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.7 m -136.3 111.6 9.11 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.457 -0.571 . . . . 2.31 109.457 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.5 mt -112.43 148.69 15.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.534 -0.303 . . . . 1.83 110.717 -178.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 7.9 m -96.83 142.41 28.86 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.298 -0.63 . . . . 2.02 109.298 178.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 17.9 mt -133.41 131.19 39.68 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.843 0.354 . . . . 1.33 111.464 179.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -85.99 109.45 18.79 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.786 -0.643 . . . . 2.4 109.316 178.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.719 HG12 ' HE3' ' A' ' 29' ' ' LYS . 16.8 m -134.0 -169.8 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.93 -0.577 . . . . 1.25 110.732 -179.141 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.441 ' O ' HD12 ' A' ' 56' ' ' LEU . 11.7 mm-40 -153.26 153.96 30.11 Favored Pre-proline 0 C--N 1.322 -0.621 0 N-CA-C 107.408 -1.33 . . . . 1.85 107.408 178.848 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_exo -53.64 -31.67 61.19 Favored 'Trans proline' 0 CA--C 1.528 0.199 0 C-N-CA 122.208 1.939 . . . . 1.78 112.122 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.5 1.42 22.41 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.046 0.758 . . . . 1.8 113.046 -179.055 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -89.0 137.79 31.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.83 0.347 . . . . 1.23 110.161 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.0 OUTLIER -83.07 154.2 24.51 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.247 -0.433 . . . . 1.44 111.084 -179.467 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 34.3 mm -56.3 -41.32 70.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.369 -0.378 . . . . 0.99 110.9 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -57.45 -37.47 72.9 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.108 -0.496 . . . . 2.22 110.677 179.09 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -67.81 -32.5 73.1 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.076 -0.511 . . . . 1.23 110.435 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.549 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 46.2 t -69.28 -40.68 80.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 108.91 -0.774 . . . . 0.64 108.91 178.404 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.566 ' HE3' ' HB2' ' A' ' 41' ' ' GLN . 6.7 mmmm -59.03 -43.28 91.6 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.527 -0.761 . . . . 1.32 109.871 179.092 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.01 -41.44 96.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.485 -0.78 . . . . 1.08 110.7 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.719 ' HE3' HG12 ' A' ' 17' ' ' VAL . 28.4 mtmm -65.11 -36.84 85.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.008 -0.542 . . . . 1.08 110.944 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.408 HG13 ' O ' ' A' ' 26' ' ' VAL . 81.7 mt -66.48 -38.06 80.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 109.973 -0.38 . . . . 1.31 109.973 178.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -68.7 -31.8 71.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.036 0.446 . . . . 1.93 110.481 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -74.64 -22.98 58.61 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.843 0.354 . . . . 2.05 111.28 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -97.45 -43.52 7.24 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.216 0.45 . . . . 2.17 112.216 -179.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 53.7 mm-40 -98.12 -31.27 12.2 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.131 0.789 . . . . 2.14 113.131 -178.633 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 91.75 5.47 66.52 Favored Glycine 0 C--N 1.324 -0.134 0 C-N-CA 120.533 -0.841 . . . . 2.01 112.152 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 65.7 mt -84.96 125.09 71.52 Favored Pre-proline 0 C--N 1.328 -0.362 0 N-CA-C 110.395 -0.224 . . . . 1.83 110.395 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_exo -55.09 140.93 80.55 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.875 2.383 . . . . 2.04 111.737 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -64.1 -13.0 35.15 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.873 2.382 . . . . 1.52 112.432 -179.31 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.58 -23.93 53.49 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.031 -0.531 . . . . 2.95 110.098 179.471 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.457 ' HA ' ' HB3' ' A' ' 72' ' ' ARG . 83.4 mt-30 -100.16 -15.93 17.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.85 -0.614 . . . . 2.56 110.555 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.566 ' HB2' ' HE3' ' A' ' 27' ' ' LYS . 79.8 mt-30 -75.84 125.05 28.35 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.96 -0.564 . . . . 1.4 111.197 -179.655 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 57.2 mtt180 -128.62 103.46 7.11 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.205 -0.452 . . . . 2.65 109.921 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.455 ' HB3' HD12 ' A' ' 50' ' ' LEU . 80.8 mt -90.06 132.11 35.57 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.343 0.498 . . . . 1.02 112.343 -178.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.501 HG12 ' CE1' ' B' ' 427' ' ' PHE . 1.1 mt -120.93 141.83 39.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.646 -0.706 . . . . 2.14 109.418 179.088 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.542 ' HB2' HD11 ' A' ' 50' ' ' LEU . 50.0 t80 -128.7 102.72 6.7 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.461 -0.336 . . . . 1.71 110.279 179.192 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 63.23 12.53 6.2 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.825 -0.625 . . . . 2.1 112.629 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 111.15 -6.88 28.9 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.863 -0.684 . . . . 1.84 112.09 -179.647 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 82.8 mttt -91.42 137.29 32.48 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.297 -0.26 . . . . 3.05 110.297 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -76.26 123.21 25.55 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 123.432 0.457 . . . . 2.3 110.244 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.542 HD11 ' HB2' ' A' ' 45' ' ' PHE . 42.8 mt -92.6 122.87 35.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.229 -0.441 . . . . 1.17 110.864 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -93.11 145.43 24.41 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.025 -0.534 . . . . 2.65 110.205 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -58.07 -42.12 84.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 1.83 112.197 -179.117 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.86 41.49 2.59 Favored Glycine 0 CA--C 1.519 0.33 0 C-N-CA 121.339 -0.458 . . . . 1.82 114.201 -178.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -134.58 158.78 43.12 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.263 -0.643 . . . . 2.69 109.263 179.073 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' A' ' 22' ' ' THR . 0.3 OUTLIER -100.7 155.44 17.89 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.912 -0.403 . . . . 1.71 109.912 179.874 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.441 HD12 ' O ' ' A' ' 18' ' ' GLU . 92.2 mt -59.63 -38.32 81.04 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.828 0.346 . . . . 1.49 111.475 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.27 -20.31 65.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.267 -0.424 . . . . 1.94 111.757 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -69.18 -31.91 70.85 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.818 0.342 . . . . 2.03 110.677 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -98.08 9.86 41.83 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.195 -0.457 . . . . 1.76 111.4 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 65.02 29.36 12.22 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.952 -0.567 . . . . 2.96 111.142 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 83.0 mt -77.47 121.09 29.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.988 -0.551 . . . . 1.65 110.249 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -113.24 -164.35 0.91 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.588 -0.733 . . . . 2.66 110.155 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.403 ' HB3' ' HB2' ' A' ' 1' ' ' MET . 56.9 pttt -73.64 147.53 43.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.596 0.236 . . . . 3.22 110.43 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 64.28 28.97 13.87 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.99 0.737 . . . . 3.12 112.99 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 50.4 m -84.38 140.81 31.31 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.577 -0.527 . . . . 1.83 109.577 178.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -94.18 114.29 26.38 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.431 -0.35 . . . . 2.03 111.305 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.0 mp -106.52 141.71 37.36 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.158 -0.682 . . . . 1.41 109.158 178.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.427 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 75.0 m80 -106.74 147.21 29.9 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 111.53 0.196 . . . . 2.76 111.53 -179.205 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 27.7 tp -120.8 116.33 25.01 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.095 0.474 . . . . 1.54 111.482 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.486 ' CG2' HD11 ' A' ' 44' ' ' ILE . 0.9 OUTLIER -96.29 143.2 12.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.819 -0.628 . . . . 1.79 110.004 179.104 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 12.4 mt -86.49 134.92 33.63 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.172 -0.467 . . . . 2.43 111.314 -179.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.457 ' HB3' ' HA ' ' A' ' 40' ' ' GLN . 0.2 OUTLIER -112.48 129.94 56.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.034 -0.53 . . . . 3.19 110.359 179.303 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.638 HD12 ' HB3' ' B' ' 420' ' ' GLU . 5.9 mt -118.41 155.36 30.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.882 0.372 . . . . 2.99 111.39 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 32.0 mmt180 -96.73 -52.96 3.71 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.116 -0.493 . . . . 3.67 110.002 178.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -144.75 145.82 15.6 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.91 -0.662 . . . . 3.08 112.082 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.885 0 N-CA-C 110.906 -0.878 . . . . 3.82 110.906 179.76 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.871 0 N-CA-C 112.041 -0.424 . . . . 5.66 112.041 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.08 98.27 5.71 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.807 0.337 . . . . 5.53 110.73 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -154.06 96.55 1.97 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.264 -0.425 . . . . 3.98 111.113 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 389' ' ' THR . . . . . 0.406 ' O ' ' HD3' ' B' ' 391' ' ' PRO . 0.2 OUTLIER -82.87 0.82 42.37 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.178 0.513 . . . . 4.15 110.45 179.212 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -107.16 101.26 37.3 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.726 -0.67 . . . . 2.51 109.733 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 391' ' ' PRO . . . . . 0.406 ' HD3' ' O ' ' B' ' 389' ' ' THR . 18.4 Cg_exo -67.52 130.04 21.39 Favored 'Trans proline' 0 C--O 1.235 0.366 0 C-N-CA 122.55 2.167 . . . . 3.77 111.124 179.683 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -54.1 -39.23 66.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.164 -0.471 . . . . 5.36 111.038 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 393' ' ' GLN . . . . . 0.418 ' O ' ' HG2' ' B' ' 397' ' ' GLN . 59.1 tt0 -59.38 -51.11 71.33 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.778 -0.647 . . . . 6.89 110.301 179.364 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 26.1 m -59.24 -45.25 91.67 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.907 -0.588 . . . . 4.2 111.091 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 395' ' ' ILE . . . . . 0.482 ' O ' ' HG2' ' B' ' 399' ' ' MET . 78.3 mt -58.09 -49.02 82.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 3.8 110.561 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 85.8 mttt -60.0 -42.26 93.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 6.27 112.001 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 397' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' B' ' 393' ' ' GLN . 21.6 mm-40 -62.87 -41.24 99.31 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.887 0.375 . . . . 6.91 110.981 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 80.8 mt -72.79 -26.49 61.54 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.083 -0.508 . . . . 4.31 111.464 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 399' ' ' MET . . . . . 0.482 ' HG2' ' O ' ' B' ' 395' ' ' ILE . 30.7 mmt -62.35 -40.25 95.77 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.315 -0.402 . . . . 5.8 111.293 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -70.45 -17.79 62.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.865 -0.607 . . . . 7.71 112.138 -178.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 401' ' ' LEU . . . . . 0.491 HD22 HD12 ' A' ' 44' ' ' ILE . 94.5 mt -69.51 -16.26 63.41 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.837 0.351 . . . . 5.69 111.75 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 96.87 32.57 6.45 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.711 -0.757 . . . . 5.87 112.178 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -126.4 144.58 49.86 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 110.486 -0.191 . . . . 4.83 110.486 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -72.77 162.78 40.26 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.697 2.265 . . . . 4.72 111.999 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' B' ' 405' ' ' ARG . 14.2 ttt180 -63.51 -28.3 69.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.835 -0.62 . . . . 4.16 111.033 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -56.21 -48.88 75.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.862 -0.608 . . . . 4.69 111.209 179.415 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -64.94 -35.74 82.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.824 -0.625 . . . . 2.99 110.644 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 73.9 t -63.22 -50.54 78.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.823 -0.626 . . . . 2.06 110.796 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 59.8 t -60.2 -44.31 95.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.502 -0.317 . . . . 2.89 111.403 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -64.15 -50.4 68.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.296 -0.411 . . . . 5.05 111.72 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -63.54 -50.04 71.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 2.96 111.703 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -59.59 -30.45 68.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.332 -0.395 . . . . 3.45 111.969 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 23.5 mmtt -67.35 -48.3 67.88 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.418 -0.355 . . . . 5.52 111.128 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 23.8 pt20 -76.09 -30.96 58.48 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 113.147 0.795 . . . . 5.53 113.147 -179.171 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 415' ' ' THR . . . . . 0.512 ' HB ' ' ND2' ' B' ' 418' ' ' ASN . 65.4 p -84.02 -8.14 59.21 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.007 0.432 . . . . 5.42 110.915 179.766 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 61.96 61.1 1.42 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.366 -0.834 . . . . 6.37 112.811 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 74.27 -23.15 1.2 Allowed Glycine 0 CA--C 1.521 0.41 0 CA-C-N 115.493 -0.776 . . . . 4.33 114.928 178.054 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 418' ' ' ASN . . . . . 0.799 HD21 ' HB2' ' B' ' 421' ' ' PHE . 0.0 OUTLIER -68.91 113.43 6.32 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 117.868 0.834 . . . . 6.25 111.807 -179.291 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 419' ' ' ALA . . . . . 0.458 ' HA ' ' HB3' ' B' ' 422' ' ' ALA . . . -73.29 -20.61 60.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.942 -1.026 . . . . 4.12 112.274 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 420' ' ' GLU . . . . . 0.638 ' HB3' HD12 ' A' ' 73' ' ' LEU . 53.2 mm-40 -61.93 -55.63 27.53 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.36 0.6 . . . . 6.99 110.041 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 421' ' ' PHE . . . . . 0.799 ' HB2' HD21 ' B' ' 418' ' ' ASN . 11.2 m-85 -75.13 -24.56 58.01 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.679 -0.692 . . . . 7.48 110.4 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 422' ' ' ALA . . . . . 0.462 ' O ' ' HG ' ' B' ' 426' ' ' LEU . . . -61.61 -46.69 88.74 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.003 -0.739 . . . . 3.68 109.003 178.645 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 423' ' ' ALA . . . . . 0.485 ' HB1' HG13 ' A' ' 70' ' ' VAL . . . -64.47 -38.84 92.43 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.85 -0.613 . . . . 3.8 109.693 179.03 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 49.1 m -66.98 -31.3 71.77 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.049 -0.523 . . . . 5.05 110.781 178.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 425' ' ' LEU . . . . . 0.548 ' O ' ' HG2' ' B' ' 428' ' ' GLN . 0.4 OUTLIER -81.65 -49.41 10.52 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.773 0.657 . . . . 4.36 112.773 -179.507 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 426' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' B' ' 422' ' ' ALA . 4.2 pp -64.88 -33.82 76.92 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 114.599 1.333 . . . . 3.21 114.599 -177.687 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 427' ' ' PHE . . . . . 0.501 ' CE1' HG12 ' A' ' 44' ' ' ILE . 62.5 t80 -76.34 0.74 18.36 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 113.174 0.805 . . . . 5.27 113.174 -178.322 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 428' ' ' GLN . . . . . 0.548 ' HG2' ' O ' ' B' ' 425' ' ' LEU . 15.6 pt20 -50.93 -46.05 60.73 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.956 0.724 . . . . 5.32 112.956 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 9.5 m . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.549 -0.739 . . . . 5.11 110.361 -179.951 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 ptt? . . . . . 0 N--CA 1.481 1.09 0 CA-C-O 120.623 0.249 . . . . 1.65 110.365 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -105.93 135.18 47.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.864 0.364 . . . . 1.92 111.753 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.1 pt -129.75 165.22 30.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 109.316 -0.624 . . . . 1.48 109.316 178.421 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.454 ' O ' ' HA ' ' A' ' 66' ' ' THR . 87.6 m-85 -122.54 127.5 49.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.646 0.26 . . . . 2.17 110.622 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.472 ' HB ' ' HB ' ' A' ' 13' ' ' ILE . 44.3 t -110.17 124.84 67.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 116.504 -0.317 . . . . 1.65 110.331 179.593 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.402 ' HE3' HG21 ' A' ' 66' ' ' THR . 75.0 mttt -91.71 149.63 21.52 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.417 -0.356 . . . . 3.16 110.625 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.3 p -126.1 167.84 14.82 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.988 -0.551 . . . . 2.17 109.605 179.533 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 33.0 mt -65.22 -23.3 67.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.067 0.461 . . . . 3.05 110.454 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.4 -5.53 56.63 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.572 -0.74 . . . . 2.7 111.124 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.18 30.12 57.59 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 121.051 -0.595 . . . . 2.64 112.523 179.678 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -104.42 129.77 52.36 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 122.774 -0.251 . . . . 2.34 110.574 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.2 m -87.85 112.01 22.02 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.316 -0.402 . . . . 2.31 110.388 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.472 ' HB ' ' HB ' ' A' ' 5' ' ' VAL . 49.0 mt -96.59 116.07 37.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.402 -0.363 . . . . 1.83 110.6 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.58 126.93 32.85 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.717 -0.845 . . . . 2.02 108.717 178.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.511 HD11 HG12 ' A' ' 30' ' ' ILE . 11.5 mt -126.96 139.2 53.21 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.988 0.736 . . . . 1.33 112.988 -178.751 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -95.13 106.74 18.77 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 114.855 -1.066 . . . . 2.4 108.716 178.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 6.4 m -140.61 171.05 13.59 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-O 120.87 0.366 . . . . 1.25 110.777 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -124.34 153.35 68.9 Favored Pre-proline 0 C--N 1.319 -0.721 0 N-CA-C 108.903 -0.777 . . . . 1.85 108.903 178.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_exo -53.49 -35.87 77.77 Favored 'Trans proline' 0 CA--C 1.53 0.305 0 C-N-CA 122.45 2.1 . . . . 1.78 112.177 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.1 m -85.02 14.56 4.82 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.54 0.571 . . . . 1.8 112.54 -179.306 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -92.61 135.69 33.86 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.213 -0.662 . . . . 1.23 109.213 178.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.45 147.79 37.68 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.269 -0.423 . . . . 1.44 111.272 -178.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.565 ' HB ' ' HA ' ' A' ' 52' ' ' ASP . 47.3 mm -56.35 -37.41 50.62 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 CA-C-N 116.48 -0.327 . . . . 0.99 110.661 179.701 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.493 ' HB2' ' HB3' ' A' ' 52' ' ' ASP . 28.4 tt0 -57.76 -40.5 79.92 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.244 -0.435 . . . . 2.22 110.673 179.257 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -69.34 -35.13 75.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.023 -0.535 . . . . 1.23 109.839 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.459 ' O ' HG13 ' A' ' 30' ' ' ILE . 59.7 t -65.54 -41.72 91.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 109.133 -0.692 . . . . 0.64 109.133 178.592 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.545 ' HE3' ' HB2' ' A' ' 41' ' ' GLN . 2.4 mmmm -60.98 -40.37 93.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.737 -0.665 . . . . 1.32 109.713 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.47 -36.26 82.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.82 -0.627 . . . . 1.08 110.173 179.127 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -65.74 -35.82 81.82 Favored 'General case' 0 C--N 1.334 -0.082 0 CA-C-N 116.132 -0.485 . . . . 1.08 110.112 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.511 HG12 HD11 ' A' ' 15' ' ' LEU . 79.5 mt -69.79 -38.31 75.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 108.801 -0.814 . . . . 1.31 108.801 178.264 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -63.95 -30.4 71.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.529 -0.759 . . . . 1.93 110.473 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -70.41 -17.25 63.01 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.005 -0.543 . . . . 2.05 110.824 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -107.6 -54.34 2.5 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.105 -0.498 . . . . 2.17 112.014 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -79.12 -36.19 41.02 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 111.916 0.339 . . . . 2.14 111.916 -178.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 94.87 -15.65 62.95 Favored Glycine 0 C--O 1.229 -0.189 0 C-N-CA 120.836 -0.697 . . . . 2.01 112.03 -179.46 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ILE . . . . . 0.402 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 54.2 mt -69.56 126.61 92.7 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 115.905 -0.148 . . . . 1.83 110.746 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.425 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 45.5 Cg_exo -58.68 145.87 94.07 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.124 2.549 . . . . 2.04 112.235 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 37' ' ' PRO . 37.1 Cg_exo -60.05 -21.51 65.6 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.263 2.642 . . . . 1.52 112.638 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.55 -19.76 65.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.265 -0.425 . . . . 2.95 111.735 -179.633 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -114.01 9.06 17.29 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.086 0.469 . . . . 2.56 110.249 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.545 ' HB2' ' HE3' ' A' ' 27' ' ' LYS . 67.5 mt-30 -98.85 108.84 21.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.622 -0.717 . . . . 1.4 110.925 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.557 ' HB3' ' CD2' ' B' ' 427' ' ' PHE . 11.1 mmt85 -104.8 104.43 14.21 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.019 0.438 . . . . 2.65 109.866 178.524 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.637 ' HB3' HD12 ' A' ' 50' ' ' LEU . 9.9 mt -102.15 134.65 45.06 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.741 -0.663 . . . . 1.02 111.699 -178.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.801 HG22 ' HA ' ' A' ' 49' ' ' GLN . 10.8 pt -138.73 160.97 30.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.989 -0.55 . . . . 2.14 110.185 178.635 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.495 ' HB2' HD21 ' A' ' 50' ' ' LEU . 53.6 t80 -134.91 106.24 6.77 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.423 -0.584 . . . . 1.71 109.423 179.051 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.92 33.42 19.87 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.086 -0.506 . . . . 2.1 111.725 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 99.95 -31.48 8.38 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.888 -0.673 . . . . 1.84 113.408 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -78.42 130.27 35.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.849 0.324 . . . . 3.05 111.404 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.801 ' HA ' HG22 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -67.77 140.94 56.68 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.914 -0.585 . . . . 2.3 110.529 179.851 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.637 HD12 ' HB3' ' A' ' 43' ' ' LEU . 72.0 mt -97.58 113.01 24.65 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.57 -0.286 . . . . 1.17 110.798 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.621 ' HB2' ' HG2' ' A' ' 54' ' ' ARG . 17.7 mt-10 -76.87 133.06 39.41 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.282 -0.417 . . . . 2.65 109.978 179.001 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.565 ' HA ' ' HB ' ' A' ' 23' ' ' ILE . 4.1 m-20 -58.94 -29.13 66.9 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.919 -0.582 . . . . 1.83 112.209 -179.198 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.53 2.16 83.36 Favored Glycine 0 CA--C 1.52 0.354 0 C-N-CA 121.055 -0.593 . . . . 1.82 113.719 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.621 ' HG2' ' HB2' ' A' ' 51' ' ' GLU . 15.7 mmt180 -107.99 166.12 10.96 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.073 0.437 . . . . 2.69 110.328 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 76.9 p -105.04 177.39 4.86 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.782 -0.451 . . . . 1.71 109.782 179.421 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.458 ' HB3' ' HB ' ' A' ' 61' ' ' ILE . 94.8 mt -67.19 -34.87 78.42 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.971 0.415 . . . . 1.49 109.882 179.071 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -27.47 68.93 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.958 -0.565 . . . . 1.94 111.368 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -65.23 -23.34 67.04 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.908 0.385 . . . . 2.03 111.704 -179.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -115.03 16.07 17.13 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.386 -0.37 . . . . 1.76 110.929 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 59.66 29.09 18.64 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.769 -0.651 . . . . 2.96 111.658 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.458 ' HB ' ' HB3' ' A' ' 56' ' ' LEU . 76.7 mt -77.48 119.61 26.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.044 -0.526 . . . . 1.65 110.335 -179.798 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 15.0 mt-30 -110.96 -167.99 1.25 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.67 -0.695 . . . . 2.66 109.496 -179.74 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 24.0 pttt -73.3 152.73 40.84 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 121.01 -0.276 . . . . 3.22 110.412 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 70.4 -1.53 2.48 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.574 0.583 . . . . 3.12 112.574 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 69.1 m -69.88 137.19 51.45 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 110.235 -0.283 . . . . 1.83 110.235 179.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.454 ' HA ' ' O ' ' A' ' 4' ' ' PHE . 3.4 m -96.57 120.41 36.84 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.168 0.509 . . . . 2.03 111.713 -179.202 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.7 mp -98.73 156.43 16.84 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.551 -0.907 . . . . 1.41 108.551 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.435 ' HB2' HG13 ' A' ' 44' ' ' ILE . 72.7 m80 -117.03 125.44 51.35 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.862 0.363 . . . . 2.76 111.937 -179.124 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.473 HD13 ' HG ' ' A' ' 43' ' ' LEU . 47.5 tp -115.58 120.36 39.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.921 -0.582 . . . . 1.54 110.521 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.2 t -112.74 138.89 40.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.005 -0.543 . . . . 1.79 110.678 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.8 mt -72.05 122.82 21.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.84 -0.618 . . . . 2.43 110.343 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 59.3 ttt180 -89.92 104.5 17.06 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.29 -0.414 . . . . 3.19 110.553 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.4 mp -69.29 113.35 6.55 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.909 -0.587 . . . . 2.99 110.546 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.4 ' HD2' HH11 ' A' ' 74' ' ' ARG . 8.6 mmt85 -82.81 -19.49 37.58 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.05 -0.523 . . . . 3.67 110.317 179.672 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -163.27 151.32 20.89 Favored Glycine 0 N--CA 1.443 -0.894 0 N-CA-C 111.258 -0.737 . . . . 3.08 111.258 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLY . . . . . 0.555 ' HA3' ' HE2' ' B' ' 421' ' ' PHE . . . . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.586 -1.119 . . . . 3.82 111.651 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.655 0 N-CA-C 111.553 -0.619 . . . . 5.66 111.553 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 2.3 m -124.9 36.5 4.59 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.083 0.468 . . . . 5.53 110.473 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -104.02 109.36 21.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.146 -0.479 . . . . 3.98 110.614 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.74 -14.49 51.46 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.336 0.589 . . . . 4.15 110.547 179.339 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 390' ' ' PHE . . . . . 0.613 ' HB2' HD11 ' B' ' 395' ' ' ILE . 0.1 OUTLIER -99.34 111.31 60.94 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.633 -0.712 . . . . 2.51 110.423 -179.694 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 391' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' B' ' 390' ' ' PHE . 10.5 Cg_exo -71.42 136.27 28.33 Favored 'Trans proline' 0 C--O 1.237 0.434 0 C-N-CA 122.792 2.328 . . . . 3.77 111.44 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.75 -36.14 69.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.231 -0.441 . . . . 5.36 112.066 -179.212 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -56.79 -52.89 63.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.045 0.45 . . . . 6.89 110.9 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -67.47 -36.24 80.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.886 -0.597 . . . . 4.2 110.948 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 395' ' ' ILE . . . . . 0.613 ' O ' ' HG2' ' B' ' 399' ' ' MET . 74.1 mt -59.59 -52.28 62.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.058 -0.519 . . . . 3.8 110.224 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 31.8 mttp -56.29 -42.7 77.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.355 -0.384 . . . . 6.27 111.445 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -61.95 -39.01 90.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.276 -0.42 . . . . 6.91 111.23 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 398' ' ' LEU . . . . . 0.413 HD12 HG23 ' B' ' 408' ' ' VAL . 90.4 mt -76.71 -31.67 57.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.401 -0.363 . . . . 4.31 111.316 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 399' ' ' MET . . . . . 0.613 ' HG2' ' O ' ' B' ' 395' ' ' ILE . 35.0 mmt -66.97 -39.96 87.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.075 0.464 . . . . 5.8 110.0 179.388 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -62.38 -28.26 69.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.572 -0.74 . . . . 7.71 111.975 -179.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 401' ' ' LEU . . . . . 0.769 ' HB3' HD11 ' A' ' 44' ' ' ILE . 38.2 mt -63.69 -26.83 68.84 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.071 0.462 . . . . 5.69 110.59 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 111.61 27.1 4.23 Favored Glycine 0 N--CA 1.446 -0.638 0 N-CA-C 111.483 -0.647 . . . . 5.87 111.483 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 403' ' ' PHE . . . . . 0.569 ' HE2' HD13 ' A' ' 44' ' ' ILE . 33.4 m-85 -113.08 143.21 28.72 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-O 120.652 0.263 . . . . 4.83 110.91 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.88 164.62 31.45 Favored 'Trans proline' 0 C--O 1.236 0.418 0 C-N-CA 123.022 2.481 . . . . 4.72 112.949 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 405' ' ' ARG . . . . . 0.501 ' HA ' HG12 ' B' ' 408' ' ' VAL . 91.0 mtt180 -64.12 -28.26 69.65 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.796 -0.638 . . . . 4.16 111.408 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -63.32 -37.71 88.33 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.011 0.434 . . . . 4.69 110.448 179.19 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -68.56 -45.19 72.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.8 -0.637 . . . . 2.99 111.453 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 408' ' ' VAL . . . . . 0.501 HG12 ' HA ' ' B' ' 405' ' ' ARG . 14.6 p -63.22 -41.23 92.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 N-CA-C 112.091 0.404 . . . . 2.06 112.091 -179.313 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 74.7 t -64.23 -50.23 77.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.902 0.382 . . . . 2.89 111.143 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -62.85 -40.52 97.69 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.295 -0.411 . . . . 5.05 111.706 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -67.89 -45.43 74.47 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.296 -0.411 . . . . 2.96 110.979 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 412' ' ' LEU . . . . . 0.449 HD13 ' HA2' ' B' ' 417' ' ' GLY . 0.8 OUTLIER -61.26 -33.72 74.0 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.198 -0.456 . . . . 3.45 111.543 -179.671 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 42.3 mmtt -69.76 -50.81 39.67 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.121 0.415 . . . . 5.52 112.121 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -70.29 -23.83 62.93 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 113.17 0.804 . . . . 5.53 113.17 -178.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 415' ' ' THR . . . . . 0.475 HG21 ' HA ' ' B' ' 422' ' ' ALA . 68.6 p -99.01 -5.02 31.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.005 0.431 . . . . 5.42 110.973 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 57.76 61.72 2.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.494 -0.775 . . . . 6.37 112.96 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 417' ' ' GLY . . . . . 0.449 ' HA2' HD13 ' B' ' 412' ' ' LEU . . . 76.92 -14.46 7.46 Favored Glycine 0 CA--C 1.519 0.314 0 N-CA-C 114.902 0.721 . . . . 4.33 114.902 177.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -71.32 94.16 1.19 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 117.733 0.767 . . . . 6.25 110.166 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -61.79 -33.34 73.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.089 -0.505 . . . . 4.12 111.853 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -65.91 -43.43 88.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.238 0.542 . . . . 6.99 109.628 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 421' ' ' PHE . . . . . 0.555 ' HE2' ' HA3' ' A' ' 76' ' ' GLY . 0.2 OUTLIER -73.53 -36.99 65.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.701 -0.681 . . . . 7.48 109.6 179.211 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 422' ' ' ALA . . . . . 0.475 ' HA ' HG21 ' B' ' 415' ' ' THR . . . -59.28 -47.02 86.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.834 -0.621 . . . . 3.68 110.529 179.321 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -60.23 -46.31 90.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.154 -0.475 . . . . 3.8 110.436 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 61.3 m -65.38 -29.18 69.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.201 -0.454 . . . . 5.05 111.519 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -80.69 -49.71 10.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.416 -0.356 . . . . 4.36 111.947 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 4.2 pp -64.09 -33.03 74.84 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.927 0.343 . . . . 3.21 111.927 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 427' ' ' PHE . . . . . 0.557 ' CD2' ' HB3' ' A' ' 42' ' ' ARG . 2.0 m-85 -63.07 -11.03 16.79 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.772 0.656 . . . . 5.27 112.772 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -67.05 -20.55 65.86 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.764 0.316 . . . . 5.32 110.943 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 1.6 m . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.775 -0.631 . . . . 5.11 110.741 179.984 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.483 ' HB2' ' HB3' ' A' ' 63' ' ' LYS . 22.7 ptt? . . . . . 0 N--CA 1.484 1.251 0 N-CA-C 110.463 -0.199 . . . . 1.65 110.463 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 55.0 mm-40 -109.4 143.06 39.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.468 0.175 . . . . 1.92 110.764 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 25.0 pt -128.7 162.83 34.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.473 -0.331 . . . . 1.48 110.535 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -118.34 112.23 19.77 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.429 -0.35 . . . . 2.17 110.921 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.82 ' HB ' ' HB ' ' A' ' 13' ' ' ILE . 25.1 t -98.86 114.58 37.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.298 -0.41 . . . . 1.65 110.602 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -86.91 125.91 34.34 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.29 -0.414 . . . . 3.16 111.132 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.17 162.15 13.49 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.045 -0.525 . . . . 2.17 109.797 179.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 85.5 mt -64.56 -11.03 30.3 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 112.235 0.457 . . . . 3.05 112.235 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.25 11.94 34.68 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.217 -0.447 . . . . 2.7 111.077 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.16 28.27 70.47 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 121.195 -0.526 . . . . 2.64 112.641 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -101.26 143.84 30.84 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 110.511 -0.181 . . . . 2.34 110.511 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.6 m -107.46 105.04 14.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.055 0.455 . . . . 2.31 110.858 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.82 ' HB ' ' HB ' ' A' ' 5' ' ' VAL . 70.9 mt -86.1 114.44 25.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.86 -0.609 . . . . 1.83 109.891 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.7 m -96.33 113.69 25.3 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.739 -0.467 . . . . 2.02 109.739 179.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.445 ' HG ' HG22 ' A' ' 13' ' ' ILE . 56.6 mt -122.64 156.63 33.92 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.97 0.414 . . . . 1.33 111.732 -179.195 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -101.01 119.36 38.63 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.458 -0.792 . . . . 2.4 109.685 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.418 ' O ' ' HG2' ' A' ' 1' ' ' MET . 13.2 m -142.22 -171.86 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 116.101 -0.5 . . . . 1.25 110.042 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.407 ' O ' HD12 ' A' ' 56' ' ' LEU . 25.5 mm-40 -152.55 156.32 33.26 Favored Pre-proline 0 C--N 1.322 -0.604 0 N-CA-C 107.903 -1.147 . . . . 1.85 107.903 179.002 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.47 ' HA ' ' HB2' ' A' ' 56' ' ' LEU . 73.4 Cg_exo -51.89 -35.16 58.79 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 122.422 2.081 . . . . 1.78 112.003 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.8 m -75.06 8.33 2.65 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.931 0.715 . . . . 1.8 112.931 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -92.41 147.96 22.49 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 122.187 -0.321 . . . . 1.23 110.451 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.8 OUTLIER -93.96 152.04 19.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.317 -0.401 . . . . 1.44 110.652 -179.515 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.433 ' HB ' ' HA ' ' A' ' 52' ' ' ASP . 49.8 mm -58.05 -43.17 84.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.398 -0.364 . . . . 0.99 110.411 179.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.619 ' HG3' ' HB3' ' A' ' 52' ' ' ASP . 37.7 mt-10 -57.88 -37.59 74.24 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.107 -0.497 . . . . 2.22 110.861 179.051 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.485 ' O ' ' HG3' ' A' ' 29' ' ' LYS . 56.2 t30 -72.67 -37.26 67.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.34 -0.391 . . . . 1.23 110.594 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 92.7 t -63.51 -46.95 93.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.199 -0.455 . . . . 0.64 110.016 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.4 mtmt -64.51 -31.87 73.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.11 -0.496 . . . . 1.32 110.72 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.62 -36.61 83.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.165 -0.47 . . . . 1.08 110.082 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 69.1 mttt -68.7 -40.34 80.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.986 -0.552 . . . . 1.08 109.744 179.216 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 50.3 mt -66.67 -38.96 82.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.991 -0.55 . . . . 1.31 109.586 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.29 -36.53 80.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.396 -0.82 . . . . 1.93 111.922 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -72.2 -38.77 68.98 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.811 0.671 . . . . 2.05 112.811 -178.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -87.03 -43.93 11.96 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 113.208 0.818 . . . . 2.17 113.208 -178.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -82.67 -22.2 34.68 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.707 0.632 . . . . 2.14 112.707 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 73.92 26.36 69.22 Favored Glycine 0 CA--C 1.517 0.197 0 C-N-CA 120.694 -0.765 . . . . 2.01 112.279 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 80.2 mt -108.12 128.28 26.03 Favored Pre-proline 0 C--N 1.326 -0.449 0 N-CA-C 110.106 -0.331 . . . . 1.83 110.106 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -55.21 132.78 54.31 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.908 2.405 . . . . 2.04 111.999 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -57.91 -22.59 55.14 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 123.031 2.487 . . . . 1.52 112.92 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.62 -29.56 67.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.766 0.317 . . . . 2.95 111.412 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -94.16 -3.79 50.3 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.288 -0.414 . . . . 2.56 110.534 -179.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -86.48 107.89 18.28 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.959 -0.564 . . . . 1.4 111.5 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.461 ' HB3' ' CE2' ' B' ' 427' ' ' PHE . 12.0 mmt85 -109.76 109.01 19.57 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.221 -0.659 . . . . 2.65 109.221 178.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.48 ' HB3' HD12 ' A' ' 50' ' ' LEU . 30.9 mt -87.07 136.61 32.86 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.016 0.436 . . . . 1.02 112.159 -179.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.723 HD11 HG23 ' A' ' 70' ' ' VAL . 1.1 mt -122.41 145.09 29.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.688 -0.687 . . . . 2.14 110.298 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.441 ' CB ' HD21 ' A' ' 50' ' ' LEU . 46.2 t80 -133.92 97.33 3.86 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.952 -0.567 . . . . 1.71 109.507 178.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 61.35 40.98 13.6 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.764 -0.653 . . . . 2.1 111.99 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.12 -5.94 84.17 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 120.949 -0.643 . . . . 1.84 113.775 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -103.36 136.27 43.42 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.858 0.329 . . . . 3.05 110.545 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.452 ' OE1' ' HD2' ' A' ' 42' ' ' ARG . 5.9 tt0 -78.61 136.42 37.5 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.618 0.247 . . . . 2.3 110.408 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.48 HD12 ' HB3' ' A' ' 43' ' ' LEU . 71.4 mt -93.88 137.25 33.31 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.916 0.389 . . . . 1.17 111.383 -179.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.598 ' HB2' ' HG2' ' A' ' 54' ' ' ARG . 3.3 mt-10 -87.9 132.21 34.29 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.116 -0.493 . . . . 2.65 109.731 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.619 ' HB3' ' HG3' ' A' ' 24' ' ' GLU . 4.1 m-20 -59.37 -32.07 69.79 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 112.906 0.706 . . . . 1.83 112.906 -179.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -87.71 33.12 4.03 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.762 -0.732 . . . . 1.82 113.697 -179.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.598 ' HG2' ' HB2' ' A' ' 51' ' ' GLU . 24.4 mmt180 -131.46 171.33 13.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.809 0.337 . . . . 2.69 110.339 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 22' ' ' THR . 67.6 p -109.09 168.61 9.24 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.285 -0.635 . . . . 1.71 109.285 179.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.47 ' HB2' ' HA ' ' A' ' 19' ' ' PRO . 65.8 mt -66.88 -29.23 69.08 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.98 0.419 . . . . 1.49 110.139 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.78 -25.87 65.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.959 -0.564 . . . . 1.94 111.226 179.303 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -62.99 -26.76 69.01 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.39 -0.368 . . . . 2.03 111.658 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.463 ' HB2' HG13 ' A' ' 61' ' ' ILE . 70.7 m-85 -112.7 9.03 19.17 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.26 -0.427 . . . . 1.76 109.999 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 58.24 39.39 25.77 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.436 -0.802 . . . . 2.96 111.314 -179.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.463 HG13 ' HB2' ' A' ' 59' ' ' TYR . 78.0 mt -76.0 109.94 10.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.807 -0.633 . . . . 1.65 110.046 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -99.0 -172.42 2.28 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.85 -0.614 . . . . 2.66 111.186 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.483 ' HB3' ' HB2' ' A' ' 1' ' ' MET . 52.8 pttt -68.6 151.01 47.32 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.246 -0.434 . . . . 3.22 112.077 -179.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 65.54 22.08 11.78 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.367 -0.833 . . . . 3.12 112.98 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.3 m -87.83 145.7 25.95 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.741 0.305 . . . . 1.83 110.299 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.2 m -95.36 128.51 42.27 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.145 -0.479 . . . . 2.03 111.597 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . 0.425 ' O ' ' HA ' ' A' ' 5' ' ' VAL . 6.8 mp -119.48 143.59 47.45 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.422 -0.955 . . . . 1.41 108.422 178.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.614 ' HB2' ' HB ' ' A' ' 44' ' ' ILE . 46.9 m80 -105.33 149.22 26.25 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 120.534 0.207 . . . . 2.76 110.729 -179.089 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 54.8 tp -126.76 111.09 13.83 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.064 0.459 . . . . 1.54 111.512 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.723 HG23 HD11 ' A' ' 44' ' ' ILE . 4.5 t -101.09 129.4 52.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.978 -0.555 . . . . 1.79 110.076 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.8 mt -86.18 97.14 10.18 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.063 -0.517 . . . . 2.43 109.649 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.41 ' HA ' ' OG ' ' B' ' 424' ' ' SER . 55.3 ttt-85 -89.62 106.28 18.35 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.098 0.475 . . . . 3.19 111.17 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 57.1 mt -84.75 -169.22 2.53 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.738 -0.664 . . . . 2.99 110.207 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 74' ' ' ARG . 17.1 mmt180 . . . . . 0 C--N 1.323 -0.566 0 N-CA-C 110.012 -0.366 . . . . 3.67 110.012 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 390' ' ' PHE . . . . . 0.508 ' HB2' HD11 ' B' ' 395' ' ' ILE . 2.1 m-85 . . . . . 0 C--O 1.233 0.201 0 N-CA-C 110.095 -0.335 . . . . 2.51 110.095 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 391' ' ' PRO . . . . . 0.464 ' O ' HG13 ' B' ' 395' ' ' ILE . 21.2 Cg_exo -66.14 125.74 14.6 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.894 2.396 . . . . 3.77 111.419 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 392' ' ' GLU . . . . . 0.514 ' HG2' ' HE3' ' B' ' 396' ' ' LYS . 40.5 tt0 -52.68 -49.39 65.37 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 112.499 0.555 . . . . 5.36 112.499 -178.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 393' ' ' GLN . . . . . 0.489 HE21 ' HB3' ' B' ' 393' ' ' GLN . 0.5 OUTLIER -53.55 -52.87 58.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 6.89 111.655 -179.831 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . 0.405 ' OG1' ' HB2' ' B' ' 391' ' ' PRO . 0.3 OUTLIER -66.08 -36.55 83.48 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.622 0.601 . . . . 4.2 112.622 -178.652 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 395' ' ' ILE . . . . . 0.508 HD11 ' HB2' ' B' ' 390' ' ' PHE . 89.1 mt -58.3 -48.84 83.83 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 N-CA-C 109.585 -0.524 . . . . 3.8 109.585 178.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 396' ' ' LYS . . . . . 0.514 ' HE3' ' HG2' ' B' ' 392' ' ' GLU . 95.3 mttt -62.98 -40.14 96.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.603 -0.726 . . . . 6.27 110.641 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 397' ' ' GLN . . . . . 0.492 ' O ' ' HG ' ' B' ' 401' ' ' LEU . 12.3 mm-40 -62.5 -47.7 82.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.16 -0.473 . . . . 6.91 110.983 179.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 398' ' ' LEU . . . . . 0.464 HD11 ' HB1' ' B' ' 419' ' ' ALA . 95.4 mt -64.8 -41.97 95.4 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.354 -0.384 . . . . 4.31 111.548 -179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 57.7 mtp -69.55 -31.6 69.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.895 0.379 . . . . 5.8 111.406 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -66.01 -18.84 65.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.943 -0.571 . . . . 7.71 111.381 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 401' ' ' LEU . . . . . 0.601 ' HA ' ' CD2' ' A' ' 68' ' ' HIS . 16.8 mt -78.51 2.28 19.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.971 -0.559 . . . . 5.69 110.933 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 93.2 41.12 4.65 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.927 -0.654 . . . . 5.87 111.844 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 403' ' ' PHE . . . . . 0.462 ' HE2' HD13 ' A' ' 44' ' ' ILE . 74.4 m-85 -132.1 146.18 60.57 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 120.524 0.202 . . . . 4.83 110.462 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -79.43 164.2 24.04 Favored 'Trans proline' 0 C--O 1.234 0.276 0 C-N-CA 122.479 2.119 . . . . 4.72 111.638 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' B' ' 405' ' ' ARG . 14.5 ttt85 -64.91 -29.21 70.14 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.337 -0.392 . . . . 4.16 110.809 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -58.51 -44.12 89.38 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.819 -0.628 . . . . 4.69 110.978 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -66.34 -38.48 87.74 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.656 -0.702 . . . . 2.99 110.476 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 67.9 t -64.01 -50.98 74.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.636 -0.711 . . . . 2.06 110.985 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 86.2 t -56.99 -51.1 73.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 112.219 0.451 . . . . 2.89 112.219 -179.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 78.9 mttt -64.68 -44.68 89.57 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 112.254 0.465 . . . . 5.05 112.254 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -65.09 -38.43 90.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.841 0.353 . . . . 2.96 110.587 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.71 -35.99 73.01 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.059 -0.519 . . . . 3.45 110.476 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? -60.23 -38.16 82.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.062 -0.517 . . . . 5.52 111.674 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -87.4 -7.43 57.72 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.962 0.727 . . . . 5.53 112.962 -179.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 415' ' ' THR . . . . . 0.494 ' HB ' ' ND2' ' B' ' 418' ' ' ASN . 16.2 p -108.46 -30.56 8.22 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.214 0.45 . . . . 5.42 112.214 -179.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 70.09 63.56 0.23 Allowed 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 114.123 1.157 . . . . 6.37 114.123 179.025 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 89.67 -26.78 8.79 Favored Glycine 0 C--N 1.32 -0.313 0 N-CA-C 115.569 0.988 . . . . 4.33 115.569 176.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 418' ' ' ASN . . . . . 0.623 HD22 ' HB2' ' B' ' 421' ' ' PHE . 0.3 OUTLIER -80.05 80.3 6.48 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 118.197 0.998 . . . . 6.25 110.361 179.476 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 419' ' ' ALA . . . . . 0.464 ' HB1' HD11 ' B' ' 398' ' ' LEU . . . -59.78 -27.05 66.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.98 -1.009 . . . . 4.12 112.125 -178.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -62.46 -41.73 98.97 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.238 -1.023 . . . . 6.99 108.238 178.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 421' ' ' PHE . . . . . 0.623 ' HB2' HD22 ' B' ' 418' ' ' ASN . 44.7 m-85 -76.98 -30.69 56.07 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.243 -0.89 . . . . 7.48 109.319 178.683 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 422' ' ' ALA . . . . . 0.437 ' HB3' ' HA ' ' B' ' 419' ' ' ALA . . . -62.95 -43.81 97.78 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.935 -0.575 . . . . 3.68 109.715 178.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.464 ' HA ' ' HG ' ' B' ' 426' ' ' LEU . . . -63.89 -39.23 93.7 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.15 -0.685 . . . . 3.8 109.15 178.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 424' ' ' SER . . . . . 0.41 ' OG ' ' HA ' ' A' ' 72' ' ' ARG . 50.9 m -62.95 -30.89 71.92 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.623 -0.717 . . . . 5.05 110.373 178.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 425' ' ' LEU . . . . . 0.65 ' O ' ' HG2' ' B' ' 428' ' ' GLN . 2.8 mm? -81.18 -49.62 10.58 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 115.808 -0.633 . . . . 4.36 111.77 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 426' ' ' LEU . . . . . 0.464 ' HG ' ' HA ' ' B' ' 423' ' ' ALA . 4.4 pp -64.22 -33.72 76.44 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.728 0.64 . . . . 3.21 112.728 -179.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 427' ' ' PHE . . . . . 0.598 ' CZ ' HG12 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -75.86 -1.4 25.11 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 113.878 1.066 . . . . 5.27 113.878 -178.697 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 428' ' ' GLN . . . . . 0.65 ' HG2' ' O ' ' B' ' 425' ' ' LEU . 3.7 pt20 -89.7 11.31 20.27 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.105 0.479 . . . . 5.32 111.258 179.325 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 C--O 1.248 1.025 0 CA-C-N 116.054 -0.521 . . . . 5.11 110.61 179.546 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.587 ' HB2' ' HB3' ' A' ' 63' ' ' LYS . 25.9 ptt? . . . . . 0 N--CA 1.481 1.076 0 CA-C-O 120.618 0.246 . . . . 1.65 110.664 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 75.3 mm-40 -99.28 134.4 42.19 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.763 0.316 . . . . 1.92 110.908 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 23.3 pt -127.53 155.8 38.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.315 -0.402 . . . . 1.48 110.087 178.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -116.9 124.56 49.75 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.404 -0.362 . . . . 2.17 110.454 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.3 t -111.21 123.49 67.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 110.108 -0.33 . . . . 1.65 110.108 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -104.31 139.95 38.56 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.446 -0.343 . . . . 3.16 110.922 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.478 ' OG1' ' HB3' ' A' ' 11' ' ' LYS . 6.4 p -107.26 174.21 5.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.345 -0.388 . . . . 2.17 110.79 179.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.585 HD11 ' HB1' ' B' ' 423' ' ' ALA . 1.2 mt -58.81 -33.55 70.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.86 -0.609 . . . . 3.05 112.086 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.91 -3.2 47.08 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.039 0.385 . . . . 2.7 112.039 -179.118 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.91 8.17 69.75 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.755 -0.736 . . . . 2.64 112.252 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.478 ' HB3' ' OG1' ' A' ' 7' ' ' THR . 77.4 tttt -79.66 121.96 25.94 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.72 -0.474 . . . . 2.34 109.72 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.8 m -103.65 128.12 51.01 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.917 0.389 . . . . 2.31 111.185 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 18.4 mt -115.17 143.41 25.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 109.685 -0.487 . . . . 1.83 109.685 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.5 m -111.96 125.6 54.24 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.652 0.263 . . . . 2.02 110.306 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.8 mp -127.01 142.57 51.52 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.277 -0.419 . . . . 1.33 110.916 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -99.19 106.2 18.33 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 116.078 -0.51 . . . . 2.4 109.967 179.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.427 ' O ' ' HG2' ' A' ' 1' ' ' MET . 7.0 m -134.16 164.08 35.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 109.307 -0.627 . . . . 1.25 109.307 179.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.481 ' HA ' ' OE1' ' A' ' 18' ' ' GLU . 5.9 mm-40 -104.92 155.34 37.72 Favored Pre-proline 0 C--N 1.32 -0.689 0 C-N-CA 121.106 -0.238 . . . . 1.85 110.439 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_exo -58.12 -17.43 31.76 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.991 2.461 . . . . 1.78 113.008 -179.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.1 -1.75 58.24 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.514 -0.312 . . . . 1.8 111.804 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -79.32 142.56 35.98 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.902 0.382 . . . . 1.23 111.032 -179.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.6 m -81.59 146.79 29.93 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.784 -0.644 . . . . 1.44 110.269 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.406 HG12 ' O ' ' A' ' 54' ' ' ARG . 43.0 mm -53.07 -44.97 52.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 O-C-N 123.202 0.314 . . . . 0.99 111.585 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -58.35 -41.22 84.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.481 -0.327 . . . . 2.22 111.527 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -63.45 -36.42 83.7 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.992 0.425 . . . . 1.23 110.383 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.402 ' O ' HG13 ' A' ' 30' ' ' ILE . 58.1 t -67.1 -42.61 88.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.989 -0.55 . . . . 0.64 109.572 178.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 27.3 mtmt -63.31 -37.38 87.04 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.207 -0.451 . . . . 1.32 110.37 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.86 -37.38 84.31 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.097 -0.501 . . . . 1.08 109.844 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -68.49 -34.21 75.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.793 -0.639 . . . . 1.08 110.143 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.402 HG13 ' O ' ' A' ' 26' ' ' VAL . 70.9 mt -70.63 -32.85 50.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 108.97 -0.752 . . . . 1.31 108.97 178.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -66.31 -32.89 74.57 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.484 -0.78 . . . . 1.93 109.383 178.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -71.79 -42.92 66.52 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.456 -0.793 . . . . 2.05 109.705 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -66.82 -59.66 3.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.675 -0.693 . . . . 2.17 112.186 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -92.0 -65.27 1.02 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.197 -0.456 . . . . 2.14 112.179 -178.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 133.54 0.72 4.0 Favored Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.323 -0.941 . . . . 2.01 112.652 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 16.7 mt -67.83 125.1 90.91 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 110.144 -0.317 . . . . 1.83 110.144 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.423 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 52.4 Cg_exo -54.84 135.89 69.77 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.73 2.286 . . . . 2.04 111.423 179.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 37' ' ' PRO . 75.6 Cg_exo -51.54 -30.58 36.29 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 123.271 2.647 . . . . 1.52 113.438 -179.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -70.16 -29.69 66.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.162 0.506 . . . . 2.95 111.584 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -89.0 -4.46 58.42 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.342 -0.39 . . . . 2.56 110.289 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -92.85 111.82 23.56 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.797 -0.638 . . . . 1.4 111.173 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.497 ' HB3' ' CZ ' ' B' ' 427' ' ' PHE . 0.9 OUTLIER -125.07 104.3 8.47 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 108.618 -0.882 . . . . 2.65 108.618 178.713 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.471 ' HB3' HD12 ' A' ' 50' ' ' LEU . 82.8 mt -81.99 138.09 34.98 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.9 0.704 . . . . 1.02 112.9 -178.088 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 65.8 mt -124.09 134.96 65.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.265 -0.88 . . . . 2.14 109.732 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.47 ' HE1' ' HB3' ' A' ' 65' ' ' SER . 57.3 t80 -124.19 107.16 10.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.446 -0.343 . . . . 1.71 110.274 179.239 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.33 35.1 23.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.882 -0.599 . . . . 2.1 112.108 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.562 ' HA2' ' HA3' ' B' ' 402' ' ' GLY . . . 92.71 -13.48 67.38 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 120.909 -0.662 . . . . 1.84 112.924 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.3 mttt -90.44 142.12 28.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.657 0.228 . . . . 3.05 110.807 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.511 HE22 ' HE1' ' B' ' 427' ' ' PHE . 6.3 tp-100 -83.61 135.76 34.49 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 110.025 -0.361 . . . . 2.3 110.025 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.471 HD12 ' HB3' ' A' ' 43' ' ' LEU . 40.7 mt -97.58 135.85 38.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.717 0.294 . . . . 1.17 110.943 -179.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.419 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 31.7 tt0 -96.51 138.48 34.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.007 0.432 . . . . 2.65 111.078 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.25 -26.49 66.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.63 -0.713 . . . . 1.83 112.527 -179.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.419 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -87.75 11.21 67.2 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.736 -0.745 . . . . 1.82 114.043 -178.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.427 HH11 ' HD3' ' A' ' 54' ' ' ARG . 41.9 mmt-85 -117.79 164.07 15.56 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 117.26 0.53 . . . . 2.69 111.11 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 61.1 p -102.05 171.83 7.27 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.175 -0.466 . . . . 1.71 110.202 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 84.0 mt -63.95 -33.72 76.36 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.105 0.479 . . . . 1.49 110.528 179.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 67.4 m -70.03 -23.94 63.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.921 -0.581 . . . . 1.94 111.332 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -67.25 -20.21 65.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.397 -0.365 . . . . 2.03 111.758 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -114.66 12.57 17.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.105 -0.498 . . . . 1.76 110.735 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.0 m-20 58.49 37.86 25.56 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.667 -0.697 . . . . 2.96 111.625 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 86.9 mt -82.76 120.5 34.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.123 -0.49 . . . . 1.65 110.112 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -106.33 -167.69 1.33 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.943 -0.571 . . . . 2.66 109.975 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.587 ' HB3' ' HB2' ' A' ' 1' ' ' MET . 10.0 pttp -76.45 150.79 36.66 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 121.116 -0.233 . . . . 3.22 110.629 179.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 70.99 14.16 6.87 Favored 'General case' 0 C--O 1.235 0.29 0 O-C-N 123.654 0.597 . . . . 3.12 112.155 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.47 ' HB3' ' HE1' ' A' ' 45' ' ' PHE . 35.5 m -79.0 149.66 32.16 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.301 -0.409 . . . . 1.83 109.976 178.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -105.04 124.69 49.97 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.117 -0.492 . . . . 2.03 111.059 -179.24 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.0 mp -110.8 138.5 47.12 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.993 -0.743 . . . . 1.41 108.993 179.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 65.3 m80 -103.31 136.96 42.1 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.711 0.291 . . . . 2.76 111.587 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 48.5 tp -123.59 102.3 7.78 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.993 -0.548 . . . . 1.54 109.96 179.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.705 ' HB ' ' CE2' ' B' ' 427' ' ' PHE . 16.5 t -92.21 135.65 26.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.041 -0.527 . . . . 1.79 109.792 179.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.567 ' H ' HD12 ' A' ' 8' ' ' LEU . 65.6 mt -83.22 124.62 30.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.374 -0.375 . . . . 2.43 111.452 -179.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 38.1 ttt180 -118.67 99.11 6.58 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.891 -0.595 . . . . 3.19 110.836 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 89.0 mt -72.42 167.44 20.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.025 -0.534 . . . . 2.99 110.457 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.472 ' HD3' ' HA ' ' A' ' 74' ' ' ARG . 0.3 OUTLIER . . . . . 0 C--N 1.323 -0.57 0 CA-C-O 120.859 0.361 . . . . 3.67 111.204 -179.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 . . . . . 0 N--CA 1.452 -0.349 0 N-CA-C 109.931 -0.396 . . . . 2.51 109.931 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo -64.91 132.42 32.3 Favored 'Trans proline' 0 C--O 1.236 0.404 0 C-N-CA 122.667 2.244 . . . . 3.77 111.606 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -51.77 -45.26 63.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.734 -0.666 . . . . 5.36 112.678 -178.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -54.5 -48.62 71.66 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.235 0.457 . . . . 6.89 112.235 -179.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.54 -39.17 93.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.286 -0.416 . . . . 4.2 110.898 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 395' ' ' ILE . . . . . 0.47 ' O ' ' HG2' ' B' ' 399' ' ' MET . 83.0 mt -62.73 -42.0 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.117 0 CA-C-N 116.19 -0.459 . . . . 3.8 110.197 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -57.18 -43.71 82.9 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.186 -0.461 . . . . 6.27 111.382 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 8.8 tp60 -65.8 -41.6 91.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.021 0.438 . . . . 6.91 110.808 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 92.8 mt -67.74 -34.94 77.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 4.31 111.908 -179.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 399' ' ' MET . . . . . 0.47 ' HG2' ' O ' ' B' ' 395' ' ' ILE . 31.5 mmt -67.27 -33.78 76.04 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.979 0.418 . . . . 5.8 110.172 179.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -61.58 -27.2 68.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.527 -0.76 . . . . 7.71 111.697 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 401' ' ' LEU . . . . . 0.42 HD22 HG22 ' A' ' 70' ' ' VAL . 30.9 mt -74.3 -6.45 48.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.12 -0.491 . . . . 5.69 112.155 -179.332 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 402' ' ' GLY . . . . . 0.562 ' HA3' ' HA2' ' A' ' 47' ' ' GLY . . . 85.53 46.36 5.51 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.609 -0.805 . . . . 5.87 112.384 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 403' ' ' PHE . . . . . 0.409 ' HA ' ' HD3' ' B' ' 404' ' ' PRO . 24.6 m-85 -125.64 156.98 70.03 Favored Pre-proline 0 C--N 1.329 -0.285 0 C-N-CA 122.205 0.202 . . . . 4.83 110.577 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 404' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' B' ' 403' ' ' PHE . 2.0 Cg_endo -84.65 146.31 10.63 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.864 2.376 . . . . 4.72 111.084 178.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.411 ' HA ' ' HE1' ' B' ' 399' ' ' MET . 37.4 ttt180 -63.58 -32.24 73.64 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.784 0.29 . . . . 4.16 111.784 -179.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -57.24 -40.07 76.85 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.154 0.502 . . . . 4.69 110.719 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -69.79 -36.69 75.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.759 -0.655 . . . . 2.99 109.931 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 49.7 t -63.24 -44.11 99.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.655 -0.702 . . . . 2.06 110.272 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 74.1 t -56.52 -49.09 79.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.002 -0.544 . . . . 2.89 109.877 179.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 51.4 mttp -63.82 -47.99 78.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.789 -0.641 . . . . 5.05 110.822 179.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 411' ' ' ALA . . . . . 0.607 ' HA ' HE21 ' B' ' 414' ' ' GLN . . . -57.32 -51.04 71.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.807 -0.633 . . . . 2.96 112.563 -178.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 5.2 mp -68.78 -31.33 70.28 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.459 0.541 . . . . 3.45 112.459 -179.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 8.8 mmtt -69.29 -41.56 76.66 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.083 0.401 . . . . 5.52 112.083 -179.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 414' ' ' GLN . . . . . 0.607 HE21 ' HA ' ' B' ' 411' ' ' ALA . 23.9 pt20 -81.15 -8.57 59.79 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.7 0.63 . . . . 5.53 112.7 -179.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 415' ' ' THR . . . . . 0.435 ' HB ' ' HB3' ' B' ' 418' ' ' ASN . 40.9 p -113.3 -4.83 13.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.792 0.329 . . . . 5.42 110.961 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 56.3 m-20 63.59 58.25 1.34 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.756 -0.656 . . . . 6.37 111.933 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 69.69 8.25 59.98 Favored Glycine 0 C--O 1.229 -0.178 0 CA-C-N 115.616 -0.72 . . . . 4.33 114.089 178.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 418' ' ' ASN . . . . . 0.435 ' HB3' ' HB ' ' B' ' 415' ' ' THR . 9.3 t-20 -76.99 82.98 3.51 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 122.324 -0.515 . . . . 6.25 109.734 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -48.16 -47.8 34.77 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 113.61 0.967 . . . . 4.12 113.61 -178.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 4.1 pm0 -65.48 -43.36 90.48 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.813 0.34 . . . . 6.99 111.889 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -69.23 -35.47 76.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.148 0.499 . . . . 7.48 110.0 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 422' ' ' ALA . . . . . 0.41 ' HB1' ' HB1' ' B' ' 411' ' ' ALA . . . -65.51 -37.51 87.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.47 -0.786 . . . . 3.68 110.397 179.005 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.585 ' HB1' HD11 ' A' ' 8' ' ' LEU . . . -60.2 -43.36 95.98 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.052 0.454 . . . . 3.8 109.991 179.207 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 65.8 m -74.85 -38.59 61.95 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.958 -0.565 . . . . 5.05 111.514 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.5 -46.23 80.51 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.584 -0.28 . . . . 4.36 111.529 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.58 -33.22 72.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.351 -0.386 . . . . 3.21 111.249 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 427' ' ' PHE . . . . . 0.705 ' CE2' ' HB ' ' A' ' 70' ' ' VAL . 0.1 OUTLIER -70.93 -0.94 10.34 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.332 0.493 . . . . 5.27 112.332 -179.882 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -70.29 -6.02 31.98 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.089 0.471 . . . . 5.32 110.996 178.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 30.0 m . . . . . 0 C--O 1.246 0.916 0 CA-C-O 118.692 -0.671 . . . . 5.11 109.871 179.036 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 ptt? . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 110.048 -0.352 . . . . 1.65 110.048 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 75.2 mm-40 -103.84 133.47 48.76 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.616 0.246 . . . . 1.92 110.986 -179.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 23.5 pt -129.3 169.34 20.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.31 -0.405 . . . . 1.48 110.04 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.443 ' O ' ' HA ' ' A' ' 66' ' ' THR . 62.4 m-85 -125.45 135.15 52.04 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.423 -0.353 . . . . 2.17 110.23 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.42 HG21 HD12 ' A' ' 15' ' ' LEU . 61.8 t -118.18 120.58 64.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.555 -0.293 . . . . 1.65 110.348 179.574 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.429 ' HE2' HG21 ' A' ' 66' ' ' THR . 38.0 mtmt -96.94 128.6 44.06 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.25 0.547 . . . . 3.16 111.48 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.06 160.07 14.55 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.655 -0.702 . . . . 2.17 110.126 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.645 ' HG ' HG22 ' A' ' 70' ' ' VAL . 0.5 OUTLIER -60.16 -28.16 67.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.78 0.324 . . . . 3.05 111.447 179.97 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.26 29.84 0.22 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.384 -0.371 . . . . 2.7 111.742 -179.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 51.66 46.49 53.78 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 121.416 -0.421 . . . . 2.64 112.75 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -126.77 153.67 45.26 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 110.128 -0.323 . . . . 2.34 110.128 -179.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.1 m -128.17 121.42 29.44 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.014 0.435 . . . . 2.31 110.725 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 5.4 mt -106.02 140.06 25.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.03 -0.532 . . . . 1.83 110.544 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.73 135.3 35.17 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.124 -0.324 . . . . 2.02 110.124 179.37 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.585 HD11 HG12 ' A' ' 30' ' ' ILE . 34.9 mt -135.3 137.46 42.48 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.946 0.403 . . . . 1.33 111.522 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -105.66 106.77 17.43 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.691 -0.686 . . . . 2.4 109.229 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 4.2 m -138.98 178.19 4.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.176 -0.466 . . . . 1.25 110.713 -179.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -127.13 155.75 75.58 Favored Pre-proline 0 C--N 1.32 -0.682 0 N-CA-C 109.442 -0.577 . . . . 1.85 109.442 179.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.605 ' HA ' ' HB2' ' A' ' 56' ' ' LEU . 76.6 Cg_exo -52.34 -29.95 40.93 Favored 'Trans proline' 0 CA--C 1.532 0.378 0 C-N-CA 122.745 2.297 . . . . 1.78 113.017 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.23 -4.37 50.33 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.399 0.518 . . . . 1.8 112.399 -179.524 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.87 135.64 40.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.743 0.306 . . . . 1.23 110.517 -179.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.91 145.21 31.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.065 -0.516 . . . . 1.44 110.261 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.527 ' HB ' ' HA ' ' A' ' 52' ' ' ASP . 46.6 mm -55.09 -43.76 71.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 O-C-N 123.111 0.257 . . . . 0.99 111.225 -179.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.539 ' HB2' ' HB3' ' A' ' 52' ' ' ASP . 27.6 tt0 -58.63 -38.93 79.13 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.318 -0.401 . . . . 2.22 110.826 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.484 ' O ' ' HG3' ' A' ' 29' ' ' LYS . 64.3 t30 -69.38 -37.34 77.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.244 -0.434 . . . . 1.23 109.939 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.439 ' O ' HG13 ' A' ' 30' ' ' ILE . 97.3 t -62.23 -42.71 96.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.966 -0.561 . . . . 0.64 109.826 179.134 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.3 mtmt -62.81 -34.78 78.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.033 -0.53 . . . . 1.32 110.815 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.56 -38.76 92.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.037 0.446 . . . . 1.08 109.81 178.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.484 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 48.7 mttt -67.57 -32.5 73.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.864 -0.607 . . . . 1.08 110.069 179.278 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.585 HG12 HD11 ' A' ' 15' ' ' LEU . 69.4 mt -69.09 -35.6 69.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.091 -0.504 . . . . 1.31 109.75 179.105 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -65.7 -31.98 73.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.176 -0.465 . . . . 1.93 110.126 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -74.79 -2.5 26.89 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.848 -0.615 . . . . 2.05 110.82 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -121.96 -45.15 2.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.305 -0.407 . . . . 2.17 112.014 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -92.63 -21.84 19.81 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.271 0.471 . . . . 2.14 112.271 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.34 19.39 78.34 Favored Glycine 0 CA--C 1.518 0.256 0 C-N-CA 120.57 -0.824 . . . . 2.01 112.115 -179.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.664 HD13 HD21 ' A' ' 71' ' ' LEU . 44.6 mt -104.49 125.73 33.31 Favored Pre-proline 0 C--N 1.327 -0.404 0 N-CA-C 110.337 -0.246 . . . . 1.83 110.337 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.408 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 46.7 Cg_exo -57.8 140.96 95.44 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.835 2.357 . . . . 2.04 112.044 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 37' ' ' PRO . 32.5 Cg_exo -60.11 -18.66 52.44 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 123.126 2.551 . . . . 1.52 112.253 -179.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -63.61 -31.71 72.96 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.835 -0.621 . . . . 2.95 110.843 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -102.61 -0.59 31.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.074 -0.512 . . . . 2.56 110.779 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.408 ' HB2' ' HA ' ' A' ' 38' ' ' PRO . 56.3 mt-30 -87.21 120.49 28.55 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.084 -0.507 . . . . 1.4 111.818 -178.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.624 ' HB3' ' HD2' ' B' ' 427' ' ' PHE . 40.8 mtt180 -126.29 124.09 39.55 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.025 -0.731 . . . . 2.65 109.025 178.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.571 ' HB3' HD12 ' A' ' 50' ' ' LEU . 85.1 mt -108.92 129.06 55.42 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.898 0.38 . . . . 1.02 111.022 -179.205 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.688 ' HB ' ' CZ ' ' B' ' 427' ' ' PHE . 1.0 OUTLIER -120.67 144.73 28.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 116.062 -0.517 . . . . 2.14 110.366 179.202 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -129.64 101.98 6.15 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.887 -0.783 . . . . 1.71 108.887 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.69 34.31 22.09 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.993 -0.549 . . . . 2.1 110.921 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.74 -9.72 76.85 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 121.038 -0.601 . . . . 1.84 113.358 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -88.72 134.19 33.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.892 0.346 . . . . 3.05 111.522 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -74.82 120.1 19.9 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.512 -0.767 . . . . 2.3 111.232 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.571 HD12 ' HB3' ' A' ' 43' ' ' LEU . 59.1 mt -86.33 110.58 19.76 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.918 -0.401 . . . . 1.17 109.918 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.543 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 33.1 tt0 -74.67 135.74 41.91 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.219 -0.446 . . . . 2.65 111.308 -179.573 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.539 ' HB3' ' HB2' ' A' ' 24' ' ' GLU . 22.2 m-20 -59.93 -31.48 69.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.673 -0.694 . . . . 1.83 111.624 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.543 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -81.93 7.43 62.99 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.924 -0.58 . . . . 1.82 113.4 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 17.7 mmt-85 -115.03 167.74 10.54 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 122.577 -0.366 . . . . 2.69 110.257 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 42.3 p -110.12 176.82 4.91 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.768 0.318 . . . . 1.71 110.615 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.605 ' HB2' ' HA ' ' A' ' 19' ' ' PRO . 80.4 mt -65.62 -36.64 84.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.282 -0.417 . . . . 1.49 111.785 -179.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.51 -25.09 66.52 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 111.912 0.338 . . . . 1.94 111.912 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -62.46 -34.8 77.54 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.887 0.375 . . . . 2.03 111.126 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -103.87 15.08 29.49 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.006 -0.543 . . . . 1.76 111.518 -179.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 59.45 40.07 21.17 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.436 0.636 . . . . 2.96 111.689 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.459 ' HB ' ' HB3' ' A' ' 56' ' ' LEU . 92.8 mt -83.11 121.66 36.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.929 -0.578 . . . . 1.65 109.883 179.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -114.94 -166.23 1.09 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.852 -0.613 . . . . 2.66 110.558 -179.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 42.6 pttt -70.09 148.3 48.93 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.493 -0.321 . . . . 3.22 111.515 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 70.96 0.13 3.27 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 113.149 0.796 . . . . 3.12 113.149 179.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 16.7 m -65.31 140.8 58.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.837 0.351 . . . . 1.83 110.393 179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.443 ' HA ' ' O ' ' A' ' 4' ' ' PHE . 3.5 m -104.33 126.92 51.85 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.022 0.439 . . . . 2.03 111.501 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.4 mp -108.0 146.35 32.62 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.801 -0.814 . . . . 1.41 108.801 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.655 ' HB2' HG22 ' A' ' 44' ' ' ILE . 44.4 m80 -105.43 134.93 47.74 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.701 0.286 . . . . 2.76 110.845 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 36.4 tp -119.76 115.72 24.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.131 -0.486 . . . . 1.54 111.394 -179.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.645 HG22 ' HG ' ' A' ' 8' ' ' LEU . 9.1 t -120.18 129.27 75.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.947 -0.569 . . . . 1.79 109.623 178.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.664 HD21 HD13 ' A' ' 36' ' ' ILE . 58.5 mt -71.5 126.48 29.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.101 -0.499 . . . . 2.43 110.916 -179.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.5 92.63 7.65 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.886 -0.597 . . . . 3.19 110.508 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 84.1 mt -77.72 128.77 34.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.276 -0.42 . . . . 2.99 110.799 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.4 mmm180 . . . . . 0 C--N 1.325 -0.486 0 CA-C-N 116.2 -0.455 . . . . 3.67 110.401 179.467 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 390' ' ' PHE . . . . . 0.799 ' HB2' HD11 ' B' ' 395' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.278 0 CA-C-O 120.642 0.258 . . . . 2.51 110.824 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -65.35 146.92 86.94 Favored 'Trans proline' 0 C--O 1.234 0.313 0 C-N-CA 122.924 2.416 . . . . 3.77 112.13 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.23 -56.55 13.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.488 -0.778 . . . . 5.36 112.917 -178.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -61.51 -43.79 98.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.268 -0.424 . . . . 6.89 111.682 -179.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . 0.539 HG23 ' HB2' ' B' ' 419' ' ' ALA . 22.3 m -55.61 -48.6 74.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.976 -0.556 . . . . 4.2 111.439 -179.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 395' ' ' ILE . . . . . 0.799 HD11 ' HB2' ' B' ' 390' ' ' PHE . 84.0 mt -61.62 -50.05 81.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.856 0.36 . . . . 3.8 110.266 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -56.6 -45.43 81.42 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.981 0.734 . . . . 6.27 112.981 -178.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.58 -33.2 75.36 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.871 -0.331 . . . . 6.91 111.519 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 84.6 mt -78.74 -25.25 44.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.849 0.356 . . . . 4.31 111.268 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 399' ' ' MET . . . . . 0.595 ' HG2' ' O ' ' B' ' 395' ' ' ILE . 31.7 mmt -73.92 -24.87 59.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.072 0.463 . . . . 5.8 109.891 179.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -61.27 -30.19 70.31 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.516 -0.765 . . . . 7.71 111.366 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 401' ' ' LEU . . . . . 0.548 ' HB2' ' HD2' ' B' ' 403' ' ' PHE . 9.8 mt -65.4 -15.35 62.5 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.955 -0.566 . . . . 5.69 111.443 -179.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 98.0 39.25 3.86 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.735 -0.745 . . . . 5.87 112.082 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 403' ' ' PHE . . . . . 0.548 ' HD2' ' HB2' ' B' ' 401' ' ' LEU . 78.8 m-85 -120.12 154.84 56.02 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-O 120.413 0.149 . . . . 4.83 110.714 -179.725 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -78.79 158.19 27.87 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.526 2.151 . . . . 4.72 112.386 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.594 ' O ' HG12 ' B' ' 408' ' ' VAL . 11.4 ttt85 -63.8 -32.01 73.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.834 -0.621 . . . . 4.16 110.838 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -61.46 -40.3 94.03 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.956 0.408 . . . . 4.69 110.54 179.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -65.77 -39.01 90.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.77 -0.65 . . . . 2.99 111.37 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 408' ' ' VAL . . . . . 0.594 HG12 ' O ' ' B' ' 405' ' ' ARG . 1.4 p -66.44 -35.03 73.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 C-N-CA 120.896 -0.322 . . . . 2.06 111.367 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 409' ' ' VAL . . . . . 0.426 HG23 ' O ' ' B' ' 405' ' ' ARG . 84.8 t -67.14 -44.62 87.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.99 0.424 . . . . 2.89 109.892 179.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -62.96 -47.06 84.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.812 -0.631 . . . . 5.05 110.587 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -63.94 -45.83 87.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.894 -0.594 . . . . 2.96 110.859 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.94 HD13 ' HA2' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -59.77 -51.44 69.73 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.432 0.531 . . . . 3.45 112.432 -179.262 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 5.9 mtpm? -60.51 -31.47 70.54 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.459 0.541 . . . . 5.52 112.459 -179.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -87.86 -18.85 28.32 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 113.362 0.875 . . . . 5.53 113.362 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 35.0 p -107.62 3.99 25.4 Favored 'General case' 0 C--O 1.236 0.36 0 O-C-N 121.858 -0.526 . . . . 5.42 111.77 -178.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 67.71 50.83 0.85 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.869 -0.605 . . . . 6.37 111.202 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.94 ' HA2' HD13 ' B' ' 412' ' ' LEU . . . 66.15 -27.33 0.16 Allowed Glycine 0 CA--C 1.528 0.848 0 N-CA-C 117.373 1.709 . . . . 4.33 117.373 176.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -58.9 113.98 2.33 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 118.588 1.194 . . . . 6.25 113.199 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 419' ' ' ALA . . . . . 0.539 ' HB2' HG23 ' B' ' 394' ' ' THR . . . -61.02 -26.01 67.3 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.33 -0.85 . . . . 4.12 113.252 -178.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 420' ' ' GLU . . . . . 0.402 ' H ' ' HG2' ' B' ' 420' ' ' GLU . 5.2 mm-40 -59.24 -56.35 23.29 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.585 0.707 . . . . 6.99 110.667 -179.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -74.95 -29.79 61.03 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.769 -0.65 . . . . 7.48 110.43 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 422' ' ' ALA . . . . . 0.466 ' HB3' ' HA ' ' B' ' 419' ' ' ALA . . . -60.47 -48.53 81.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.702 -0.681 . . . . 3.68 110.193 179.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.518 ' O ' ' HB2' ' B' ' 427' ' ' PHE . . . -62.81 -38.78 92.06 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.873 -0.603 . . . . 3.8 110.006 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 69.0 m -64.28 -31.53 72.77 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.038 -0.528 . . . . 5.05 110.731 178.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 425' ' ' LEU . . . . . 0.619 ' O ' ' HG2' ' B' ' 428' ' ' GLN . 1.1 mm? -81.9 -48.94 10.91 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 112.903 0.705 . . . . 4.36 112.903 -179.316 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.5 pp -64.02 -33.21 75.22 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.768 0.655 . . . . 3.21 112.768 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 427' ' ' PHE . . . . . 0.688 ' CZ ' ' HB ' ' A' ' 44' ' ' ILE . 0.2 OUTLIER -69.3 -1.24 7.64 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 113.893 1.071 . . . . 5.27 113.893 -179.052 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 428' ' ' GLN . . . . . 0.619 ' HG2' ' O ' ' B' ' 425' ' ' LEU . 11.8 pt20 -113.89 23.45 13.0 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.499 0.555 . . . . 5.32 112.499 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 13.3 m . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.584 -0.722 . . . . 5.11 110.302 179.526 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ptt? . . . . . 0 N--CA 1.482 1.152 0 N-CA-C 110.179 -0.304 . . . . 1.65 110.179 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 46.0 mm-40 -107.84 142.62 37.63 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.583 0.23 . . . . 1.92 110.796 -179.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 18.1 pt -130.89 153.75 39.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.399 -0.364 . . . . 1.48 110.258 179.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -105.16 119.54 39.3 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.544 -0.298 . . . . 2.17 110.597 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.42 ' O ' ' HA ' ' A' ' 12' ' ' THR . 21.3 t -103.16 119.35 51.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 110.027 -0.36 . . . . 1.65 110.027 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -103.12 131.74 49.91 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.266 -0.424 . . . . 3.16 110.983 -179.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.71 161.5 13.57 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.139 -0.482 . . . . 2.17 109.877 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.502 HD11 HG13 ' A' ' 70' ' ' VAL . 78.0 mt -59.39 -23.6 62.74 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.258 0.466 . . . . 3.05 112.258 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -79.91 -8.08 59.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.98 0.419 . . . . 2.7 111.699 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.12 3.01 57.97 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.765 -0.731 . . . . 2.64 111.968 -179.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -75.44 146.47 40.69 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.457 -0.571 . . . . 2.34 109.457 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.42 ' HA ' ' O ' ' A' ' 5' ' ' VAL . 2.2 m -139.26 119.71 13.92 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.726 0.298 . . . . 2.31 110.897 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 24.4 pt -119.33 148.83 22.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.537 -0.301 . . . . 1.83 110.818 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 6.6 m -103.91 111.64 24.26 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.918 0.389 . . . . 2.02 110.391 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.422 HD21 ' HG3' ' A' ' 33' ' ' LYS . 72.5 mt -104.47 152.39 22.4 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.22 -0.445 . . . . 1.33 111.126 -179.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -98.96 121.23 40.65 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.882 -0.599 . . . . 2.4 110.739 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 5.8 m -138.5 163.58 28.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 116.158 -0.474 . . . . 1.25 110.684 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.541 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 20.5 mm-40 -117.94 158.3 46.25 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 116.034 -0.53 . . . . 1.85 109.778 179.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -58.29 -23.65 63.75 Favored 'Trans proline' 0 N--CA 1.475 0.405 0 C-N-CA 122.607 2.205 . . . . 1.78 112.388 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -92.71 3.76 55.01 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.171 -0.468 . . . . 1.8 111.599 -179.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.541 ' HB2' ' O ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -77.45 130.46 37.05 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 120.833 0.349 . . . . 1.23 110.916 -179.69 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.22 155.23 27.46 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.131 -0.692 . . . . 1.44 109.131 178.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.596 ' HB ' ' HA ' ' A' ' 52' ' ' ASP . 43.7 mm -58.59 -38.18 69.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 120.518 0.199 . . . . 0.99 111.347 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -60.62 -34.91 74.95 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.114 0.483 . . . . 2.22 110.3 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.423 ' O ' ' HG3' ' A' ' 29' ' ' LYS . 8.4 m-20 -65.0 -36.14 83.45 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 115.98 -0.555 . . . . 1.23 110.377 179.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 22.0 t -66.04 -38.63 82.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.076 -0.511 . . . . 0.64 109.648 179.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 23' ' ' ILE . 4.5 mmmm -61.0 -40.9 95.29 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.723 -0.671 . . . . 1.32 109.948 179.369 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.67 -36.08 82.63 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.638 -0.71 . . . . 1.08 110.588 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 87.4 mttt -68.52 -39.93 81.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.423 -0.353 . . . . 1.08 110.47 179.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 81.7 mt -66.8 -36.32 76.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 109.41 -0.589 . . . . 1.31 109.41 178.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -66.82 -33.48 75.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.76 -0.654 . . . . 1.93 110.038 179.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -69.41 -34.56 74.66 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.699 -0.682 . . . . 2.05 110.821 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.422 ' HG3' HD21 ' A' ' 15' ' ' LEU . 74.3 mmtt -84.88 -61.46 1.77 Allowed 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.581 0.585 . . . . 2.17 112.581 -179.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -80.73 -45.94 16.29 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 113.089 0.774 . . . . 2.14 113.089 -177.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 99.33 25.44 9.42 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.517 -0.849 . . . . 2.01 111.576 -178.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 71.9 mt -98.62 127.66 35.1 Favored Pre-proline 0 C--N 1.326 -0.451 0 N-CA-C 109.617 -0.512 . . . . 1.83 109.617 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.424 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 77.5 Cg_exo -50.97 133.41 40.42 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.991 2.461 . . . . 2.04 112.104 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 37' ' ' PRO . 32.2 Cg_exo -59.53 -19.68 53.42 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 123.338 2.692 . . . . 1.52 112.625 -179.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -21.14 58.52 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.349 -0.387 . . . . 2.95 110.92 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -98.14 -13.9 20.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.139 0.495 . . . . 2.56 110.373 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -78.84 122.83 26.57 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.809 -0.632 . . . . 1.4 111.951 -179.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.453 ' HD2' ' OE1' ' A' ' 49' ' ' GLN . 14.1 mmt85 -121.44 107.61 12.67 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.189 -0.671 . . . . 2.65 109.189 177.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.807 ' HB3' HD12 ' A' ' 50' ' ' LEU . 69.7 mt -91.87 125.47 36.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.084 -0.507 . . . . 1.02 112.309 -178.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.631 ' HB ' ' HB2' ' A' ' 68' ' ' HIS . 43.9 mt -117.23 146.18 22.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.639 -0.709 . . . . 2.14 109.816 179.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -132.8 93.16 3.16 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.39 -0.368 . . . . 1.71 110.36 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 56.29 50.46 13.27 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 113.002 0.741 . . . . 2.1 113.002 179.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.417 ' HA2' ' HA3' ' B' ' 402' ' ' GLY . . . 96.63 -38.69 3.01 Favored Glycine 0 CA--C 1.517 0.172 0 C-N-CA 120.721 -0.752 . . . . 1.84 113.525 179.193 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -85.8 153.27 22.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.67 0.235 . . . . 3.05 110.513 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.453 ' OE1' ' HD2' ' A' ' 42' ' ' ARG . 9.9 tt0 -97.77 145.57 26.24 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.998 0.428 . . . . 2.3 111.031 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.807 HD12 ' HB3' ' A' ' 43' ' ' LEU . 73.0 mt -89.71 122.97 33.32 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.652 -0.703 . . . . 1.17 110.441 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.581 ' HB3' ' HG2' ' A' ' 54' ' ' ARG . 0.1 OUTLIER -88.83 130.14 35.44 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.094 -0.503 . . . . 2.65 110.225 -179.721 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.596 ' HA ' ' HB ' ' A' ' 23' ' ' ILE . 35.7 m-20 -54.69 -28.31 46.75 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.045 0.387 . . . . 1.83 112.045 -179.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -85.38 10.86 62.65 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.918 -0.658 . . . . 1.82 113.231 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.581 ' HG2' ' HB3' ' A' ' 51' ' ' GLU . 81.6 mmt-85 -115.75 169.92 8.84 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 117.011 0.405 . . . . 2.69 110.866 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 25.9 p -111.61 166.16 11.39 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.773 -0.649 . . . . 1.71 109.638 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.456 HD12 ' O ' ' A' ' 18' ' ' GLU . 83.7 mt -64.16 -28.45 69.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.067 0.461 . . . . 1.49 110.942 179.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.8 m -73.08 -19.59 61.13 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.866 -0.606 . . . . 1.94 111.698 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -66.7 -34.22 77.36 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.103 0.478 . . . . 2.03 110.65 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.41 ' HB2' HG13 ' A' ' 61' ' ' ILE . 60.3 m-85 -101.69 8.95 41.41 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.807 -0.633 . . . . 1.76 109.934 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 53.37 49.71 19.12 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.653 -0.703 . . . . 2.96 110.512 -179.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.41 HG13 ' HB2' ' A' ' 59' ' ' TYR . 79.8 mt -81.67 106.88 13.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.47 -0.786 . . . . 1.65 110.003 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -84.76 177.98 7.81 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.718 -0.674 . . . . 2.66 110.399 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.87 148.66 51.64 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.199 -0.455 . . . . 3.22 110.173 179.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 74.17 8.69 4.63 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 113.065 0.765 . . . . 3.12 113.065 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.6 m -70.94 150.35 45.8 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 122.13 -0.357 . . . . 1.83 110.958 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.6 m -104.14 127.71 51.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.047 0.451 . . . . 2.03 111.109 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.8 mp -111.08 145.75 38.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.669 -0.696 . . . . 1.41 109.314 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.631 ' HB2' ' HB ' ' A' ' 44' ' ' ILE . 65.3 m80 -102.74 129.7 49.45 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.749 0.309 . . . . 2.76 111.631 -179.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 51.6 tp -110.12 105.68 14.86 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.945 -0.571 . . . . 1.54 110.483 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.502 HG13 HD11 ' A' ' 8' ' ' LEU . 62.6 t -98.01 137.0 26.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 115.884 -0.598 . . . . 1.79 110.424 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 66.9 mt -86.62 107.95 18.4 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.047 -0.524 . . . . 2.43 109.625 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.479 HH21 ' HA ' ' B' ' 428' ' ' GLN . 0.4 OUTLIER -104.13 95.3 5.88 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.241 -0.436 . . . . 3.19 111.037 -179.404 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 42.7 mt -80.56 161.7 24.65 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.045 -0.525 . . . . 2.99 109.625 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.1 mmt180 . . . . . 0 C--N 1.324 -0.509 0 CA-C-O 120.856 0.36 . . . . 3.67 110.994 -179.794 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 390' ' ' PHE . . . . . 0.587 ' HD1' HD11 ' B' ' 395' ' ' ILE . 0.5 OUTLIER . . . . . 0 N--CA 1.455 -0.205 0 CA-C-O 120.67 0.272 . . . . 2.51 110.721 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 391' ' ' PRO . . . . . 0.454 ' O ' HG13 ' B' ' 395' ' ' ILE . 32.0 Cg_exo -60.16 149.98 81.98 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 122.87 2.38 . . . . 3.77 112.421 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -53.51 -46.45 70.09 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.651 -0.704 . . . . 5.36 112.719 -179.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 393' ' ' GLN . . . . . 0.511 ' O ' ' HG2' ' B' ' 397' ' ' GLN . 5.5 tt0 -54.88 -51.29 66.43 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.828 0.347 . . . . 6.89 111.499 -179.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -39.72 86.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.948 -0.569 . . . . 4.2 111.736 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 395' ' ' ILE . . . . . 0.587 HD11 ' HD1' ' B' ' 390' ' ' PHE . 73.3 mt -61.71 -51.36 73.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-O 120.884 0.373 . . . . 3.8 109.996 179.63 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -55.12 -33.68 63.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.788 -0.642 . . . . 6.27 112.57 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 397' ' ' GLN . . . . . 0.511 ' HG2' ' O ' ' B' ' 393' ' ' GLN . 19.9 mm-40 -69.32 -53.57 18.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.941 0.4 . . . . 6.91 110.822 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 88.8 mt -67.57 -29.45 68.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.023 -0.535 . . . . 4.31 112.3 -178.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 28.6 mmt -68.96 -27.57 65.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.62 0.248 . . . . 5.8 111.45 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -71.45 -19.57 62.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.044 -0.525 . . . . 7.71 111.537 -179.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 47.5 mt -69.62 -26.53 64.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.231 -0.441 . . . . 5.69 110.966 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 402' ' ' GLY . . . . . 0.417 ' HA3' ' HA2' ' A' ' 47' ' ' GLY . . . 112.83 6.75 22.67 Favored Glycine 0 N--CA 1.453 -0.172 0 C-N-CA 120.685 -0.769 . . . . 5.87 112.567 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -89.64 150.14 43.62 Favored Pre-proline 0 C--N 1.328 -0.354 0 N-CA-C 110.393 -0.225 . . . . 4.83 110.393 179.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -72.65 156.47 53.52 Favored 'Trans proline' 0 C--O 1.236 0.393 0 C-N-CA 122.457 2.105 . . . . 4.72 111.347 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.422 HH11 ' HD3' ' B' ' 405' ' ' ARG . 36.3 ttt-85 -60.65 -30.7 70.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.51 -0.314 . . . . 4.16 111.498 -179.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -58.89 -38.69 79.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.332 -0.395 . . . . 4.69 110.844 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -62.37 -38.56 90.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.968 -0.56 . . . . 2.99 110.041 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 408' ' ' VAL . . . . . 0.672 HG13 HD23 ' B' ' 412' ' ' LEU . 2.6 t -65.33 -43.53 94.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.898 -0.592 . . . . 2.06 110.647 179.59 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 409' ' ' VAL . . . . . 0.412 ' O ' ' HB2' ' B' ' 413' ' ' LYS . 48.7 t -57.06 -49.03 80.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.248 -0.433 . . . . 2.89 110.45 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 75.6 mttt -68.08 -48.0 66.72 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.94 -0.573 . . . . 5.05 111.717 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -60.75 -50.71 72.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.321 0.489 . . . . 2.96 112.321 -179.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.672 HD23 HG13 ' B' ' 408' ' ' VAL . 3.8 mm? -65.17 -30.83 71.78 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.466 0.543 . . . . 3.45 112.466 -178.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 413' ' ' LYS . . . . . 0.412 ' HB2' ' O ' ' B' ' 409' ' ' VAL . 6.8 mmtt -68.84 -37.97 79.5 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 111.83 0.308 . . . . 5.52 111.83 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 29.2 pt20 -87.68 -8.13 56.52 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 113.018 0.748 . . . . 5.53 113.018 -179.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 415' ' ' THR . . . . . 0.532 HG21 ' HA ' ' B' ' 422' ' ' ALA . 25.1 p -109.22 -19.39 13.34 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 120.934 0.397 . . . . 5.42 111.574 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 68.3 62.1 0.38 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.19 0.811 . . . . 6.37 113.19 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 79.44 -23.34 3.47 Favored Glycine 0 CA--C 1.521 0.465 0 N-CA-C 115.547 0.979 . . . . 4.33 115.547 177.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -65.94 103.33 0.91 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 117.585 0.692 . . . . 6.25 110.546 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -67.13 -38.72 86.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.914 -0.585 . . . . 4.12 111.614 -179.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -66.24 -38.74 88.6 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-O 121.299 0.571 . . . . 6.99 110.018 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -72.92 -36.01 67.17 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.876 -0.787 . . . . 7.48 108.876 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 422' ' ' ALA . . . . . 0.532 ' HA ' HG21 ' B' ' 415' ' ' THR . . . -62.69 -43.25 99.29 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.734 -0.666 . . . . 3.68 110.161 178.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.481 ' HB1' ' CG1' ' A' ' 70' ' ' VAL . . . -61.16 -38.18 85.54 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.215 0.531 . . . . 3.8 110.151 179.282 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 17.7 m -72.35 -34.85 68.31 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.53 -0.759 . . . . 5.05 110.45 178.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -71.53 -46.12 60.48 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.993 -0.548 . . . . 4.36 111.715 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.7 pp -65.41 -34.08 77.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.107 0.479 . . . . 3.21 111.136 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 427' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -77.16 2.88 14.03 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 113.405 0.891 . . . . 5.27 113.405 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 428' ' ' GLN . . . . . 0.479 ' HA ' HH21 ' A' ' 72' ' ' ARG . 2.5 pt20 -57.66 -23.42 51.24 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 120.799 0.333 . . . . 5.32 110.76 178.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.667 -0.682 . . . . 5.11 110.276 179.699 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.455 ' HB2' ' HB3' ' A' ' 63' ' ' LYS . 26.1 ptt? . . . . . 0 N--CA 1.483 1.209 0 CA-C-O 120.569 0.223 . . . . 1.65 110.694 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 71.0 mm-40 -112.48 145.31 40.44 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.901 0.381 . . . . 1.92 111.953 -179.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 20.2 pt -130.12 155.04 41.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.993 -0.549 . . . . 1.48 109.54 178.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -111.14 115.14 28.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.736 0.303 . . . . 2.17 110.899 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.6 t -99.97 119.79 48.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.389 -0.368 . . . . 1.65 110.615 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.7 ' HE3' HG21 ' A' ' 66' ' ' THR . 89.5 mttt -94.57 128.98 41.56 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.299 -0.41 . . . . 3.16 110.566 179.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.22 163.65 12.31 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.206 -0.452 . . . . 2.17 110.088 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 27.9 mt -62.85 -20.8 65.44 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.937 0.399 . . . . 3.05 111.72 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.3 p -81.84 -3.76 54.83 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.245 -0.434 . . . . 2.7 110.846 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.78 -6.87 77.19 Favored Glycine 0 C--N 1.335 0.492 0 N-CA-C 111.369 -0.692 . . . . 2.64 111.369 -179.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -68.32 149.67 49.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.35 -0.425 . . . . 2.34 110.811 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.3 m -126.19 128.37 47.14 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.366 -0.605 . . . . 2.31 109.366 178.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.2 mt -113.35 129.45 69.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.651 -0.25 . . . . 1.83 111.461 -178.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.96 110.03 22.31 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.995 -0.743 . . . . 2.02 108.995 178.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.7 mt -114.77 142.05 47.05 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.513 0.56 . . . . 1.33 112.513 -178.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -84.44 120.24 26.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.423 -0.808 . . . . 2.4 109.401 179.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 15.3 m -142.34 178.8 2.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 116.146 -0.479 . . . . 1.25 109.998 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -145.71 163.26 32.3 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 109.019 -0.734 . . . . 1.85 109.019 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -55.82 -27.04 60.41 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.418 2.078 . . . . 1.78 112.758 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.07 11.44 18.44 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.301 -0.409 . . . . 1.8 111.78 -179.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -86.66 134.17 33.63 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.031 -0.359 . . . . 1.23 110.031 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.41 ' O ' HG23 ' A' ' 26' ' ' VAL . 0.7 OUTLIER -92.36 148.69 21.92 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.38 -0.373 . . . . 1.44 110.698 -179.96 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.607 ' HB ' ' HA ' ' A' ' 52' ' ' ASP . 44.8 mm -55.36 -41.1 60.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.376 -0.374 . . . . 0.99 111.792 -179.59 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -65.17 -30.04 70.92 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.881 0.372 . . . . 2.22 111.266 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -76.2 -37.21 58.09 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.586 -0.524 . . . . 1.23 109.586 179.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 22' ' ' THR . 66.8 t -64.76 -37.13 79.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.854 -0.612 . . . . 0.64 109.922 178.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -60.52 -37.1 80.07 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.79 -0.641 . . . . 1.32 111.074 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.29 -36.66 84.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 1.08 110.282 179.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 87.0 mttt -65.72 -38.23 88.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.835 -0.62 . . . . 1.08 110.265 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 47.3 mt -70.32 -30.95 45.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.176 -0.465 . . . . 1.31 110.312 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -71.09 -34.54 71.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.96 0.409 . . . . 1.93 110.205 179.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -72.59 -33.68 66.9 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.145 0.497 . . . . 2.05 110.681 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -83.62 -63.11 1.41 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.026 -0.534 . . . . 2.17 112.43 -179.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -79.7 -48.61 13.39 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.479 0.548 . . . . 2.14 112.479 -178.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 115.8 -12.2 17.94 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.707 -0.759 . . . . 2.01 111.727 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.424 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 13.0 mt -68.57 124.29 89.67 Favored Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 110.338 -0.245 . . . . 1.83 110.338 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.443 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 33.6 Cg_exo -63.12 143.62 90.65 Favored 'Trans proline' 0 C--O 1.233 0.274 0 C-N-CA 122.84 2.36 . . . . 2.04 111.457 179.275 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 37' ' ' PRO . 50.0 Cg_exo -56.7 -23.64 50.57 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.332 2.688 . . . . 1.52 112.297 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.96 -23.41 65.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.97 -0.559 . . . . 2.95 110.612 179.55 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.403 ' HA ' ' HB3' ' A' ' 72' ' ' ARG . 32.9 mt-30 -112.06 9.37 20.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.955 -0.566 . . . . 2.56 110.543 -179.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -97.0 100.16 11.68 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.767 -0.651 . . . . 1.4 111.244 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 52.4 mtp180 -104.46 103.89 13.66 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.05 -0.722 . . . . 2.65 109.05 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.3 mp -104.51 144.1 32.14 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.885 0.698 . . . . 1.02 112.885 -178.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.596 HG13 ' HB2' ' A' ' 68' ' ' HIS . 1.0 OUTLIER -135.44 151.37 30.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.36 -0.836 . . . . 2.14 110.268 179.048 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.481 ' HB2' HD21 ' A' ' 50' ' ' LEU . 61.6 t80 -121.02 87.74 2.81 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.104 -0.702 . . . . 1.71 109.104 178.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 56.1 65.86 1.34 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.826 -0.625 . . . . 2.1 111.946 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 76.13 -9.28 19.86 Favored Glycine 0 CA--C 1.521 0.467 0 CA-C-N 115.801 -0.636 . . . . 1.84 114.301 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.424 ' HE2' ' O ' ' A' ' 45' ' ' PHE . 27.3 mtmm -100.88 124.61 46.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 117.25 0.525 . . . . 3.05 111.192 -179.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -75.43 134.55 40.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.25 -0.432 . . . . 2.3 110.489 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.481 HD21 ' HB2' ' A' ' 45' ' ' PHE . 36.8 mt -93.07 125.56 37.72 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.295 -0.411 . . . . 1.17 111.24 -179.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.428 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 32.3 tt0 -89.11 132.16 34.93 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.81 -0.441 . . . . 2.65 109.81 179.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.607 ' HA ' ' HB ' ' A' ' 23' ' ' ILE . 24.0 m-20 -56.19 -30.66 62.57 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.974 0.731 . . . . 1.83 112.974 -178.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.428 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -87.72 18.23 40.22 Favored Glycine 0 CA--C 1.519 0.286 0 C-N-CA 120.948 -0.644 . . . . 1.82 113.356 -179.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 22.4 mmm-85 -120.28 163.61 17.55 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.966 0.383 . . . . 2.69 111.099 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.472 ' O ' ' HB2' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -103.42 169.19 8.68 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.674 -0.694 . . . . 1.71 110.211 179.753 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.444 ' HB3' ' HB ' ' A' ' 61' ' ' ILE . 72.8 mt -63.33 -33.84 76.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.824 0.345 . . . . 1.49 111.527 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.08 -19.1 65.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.188 -0.46 . . . . 1.94 111.329 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.472 ' HB2' ' O ' ' A' ' 55' ' ' THR . 1.5 m-20 -65.38 -31.15 72.11 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 116.233 -0.439 . . . . 2.03 111.548 -179.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.444 ' HB2' HG13 ' A' ' 61' ' ' ILE . 47.1 m-85 -111.91 14.23 20.91 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.287 -0.415 . . . . 1.76 110.407 -179.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 48.8 t30 59.67 34.14 22.08 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.455 -0.793 . . . . 2.96 111.289 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.444 ' HB ' ' HB3' ' A' ' 56' ' ' LEU . 72.7 mt -75.66 109.8 9.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.848 -0.615 . . . . 1.65 109.725 179.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -106.14 -166.6 1.21 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.871 -0.604 . . . . 2.66 110.685 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.455 ' HB3' ' HB2' ' A' ' 1' ' ' MET . 8.3 pttm -68.95 145.26 53.78 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.409 -0.359 . . . . 3.22 110.993 179.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 71.74 8.34 6.09 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.495 0.924 . . . . 3.12 113.495 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.436 ' HB3' ' HE1' ' A' ' 45' ' ' PHE . 28.1 m -72.03 143.31 49.19 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.754 0.312 . . . . 1.83 110.262 179.22 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.7 HG21 ' HE3' ' A' ' 6' ' ' LYS . 0.2 OUTLIER -100.43 125.7 46.75 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.192 -0.458 . . . . 2.03 111.21 -179.666 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.0 mp -114.54 146.14 41.1 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.491 -0.929 . . . . 1.41 108.491 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.596 ' HB2' HG13 ' A' ' 44' ' ' ILE . 63.8 m80 -109.63 137.63 47.17 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 120.726 0.298 . . . . 2.76 111.56 -179.046 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 52.0 tp -118.35 116.48 26.83 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.934 -0.575 . . . . 1.54 111.128 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 22.9 t -98.71 129.28 49.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.691 -0.686 . . . . 1.79 109.648 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 58.3 mt -76.06 117.74 18.09 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.769 -0.65 . . . . 2.43 111.106 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.403 ' HB3' ' HA ' ' A' ' 40' ' ' GLN . 60.3 ttt180 -93.27 103.15 15.42 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.832 -0.622 . . . . 3.19 110.815 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 34.9 mt -78.8 120.88 24.07 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.099 -0.501 . . . . 2.99 110.71 179.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 . . . . . 0 C--N 1.325 -0.471 0 CA-C-N 116.255 -0.429 . . . . 3.67 110.669 179.77 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 390' ' ' PHE . . . . . 0.406 ' HA ' ' HD3' ' B' ' 391' ' ' PRO . 26.0 m-85 . . . . . 0 N--CA 1.452 -0.358 0 CA-C-O 120.6 0.238 . . . . 2.51 110.439 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 391' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' B' ' 390' ' ' PHE . 15.3 Cg_exo -70.04 130.87 19.71 Favored 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.792 2.328 . . . . 3.77 111.359 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -50.67 -49.22 57.72 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.886 0.699 . . . . 5.36 112.886 -179.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -60.22 -42.15 94.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.437 -0.347 . . . . 6.89 111.086 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 11.2 m -63.74 -43.4 96.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.037 -0.528 . . . . 4.2 110.969 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 395' ' ' ILE . . . . . . . . . . . . . 84.8 mt -59.14 -49.27 83.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.493 -0.321 . . . . 3.8 110.685 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -61.51 -42.95 99.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.007 -0.542 . . . . 6.27 111.281 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -64.6 -44.67 89.87 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.777 0.322 . . . . 6.91 111.217 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 98.1 mt -66.59 -37.97 86.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 4.31 111.717 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 399' ' ' MET . . . . . 0.401 ' HA ' ' O ' ' B' ' 403' ' ' PHE . 39.0 mtp -67.51 -32.79 73.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.459 -0.337 . . . . 5.8 111.397 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -65.66 -28.55 69.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.267 -0.424 . . . . 7.71 111.215 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 401' ' ' LEU . . . . . 0.432 HD22 ' HB3' ' A' ' 68' ' ' HIS . 14.3 mt -64.97 -18.46 65.29 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.131 0.491 . . . . 5.69 110.681 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 107.91 23.28 6.85 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.76 -0.655 . . . . 5.87 111.524 -179.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 403' ' ' PHE . . . . . 0.401 ' O ' ' HA ' ' B' ' 399' ' ' MET . 39.9 m-85 -114.38 139.44 23.88 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-O 120.768 0.318 . . . . 4.83 110.806 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -77.16 164.39 29.39 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.671 2.248 . . . . 4.72 112.056 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 56.3 mtt180 -60.11 -28.06 67.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.835 -0.62 . . . . 4.16 110.798 179.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -58.07 -44.65 87.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.712 -0.676 . . . . 4.69 110.675 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -67.66 -36.3 80.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.635 -0.711 . . . . 2.99 110.117 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 91.0 t -60.96 -53.27 51.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.659 -0.7 . . . . 2.06 110.521 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 88.1 t -54.8 -49.51 68.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.136 -0.484 . . . . 2.89 112.046 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -66.23 -49.51 66.98 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.747 0.647 . . . . 5.05 112.747 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 411' ' ' ALA . . . . . 0.595 ' HA ' HE21 ' B' ' 414' ' ' GLN . . . -64.16 -48.5 75.76 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.374 0.509 . . . . 2.96 112.374 -178.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -62.72 -39.82 95.24 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.463 0.542 . . . . 3.45 112.463 -178.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 13.4 mmmt -64.26 -42.29 96.53 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.147 0.425 . . . . 5.52 112.147 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 414' ' ' GLN . . . . . 0.595 HE21 ' HA ' ' B' ' 411' ' ' ALA . 30.0 pt20 -77.87 -8.91 58.71 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.478 0.547 . . . . 5.53 112.478 -179.21 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 25.3 p -113.3 8.23 17.99 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.754 0.311 . . . . 5.42 111.63 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 61.33 39.78 15.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.071 -0.513 . . . . 6.37 112.362 179.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 79.7 -15.68 13.56 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.715 -0.755 . . . . 4.33 114.194 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 418' ' ' ASN . . . . . 0.78 HD21 ' HB2' ' B' ' 421' ' ' PHE . 0.1 OUTLIER -67.9 106.06 2.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 117.973 0.886 . . . . 6.25 110.99 -179.916 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 419' ' ' ALA . . . . . 0.453 ' HA ' ' HB3' ' B' ' 422' ' ' ALA . . . -62.59 -25.8 68.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.969 -1.014 . . . . 4.12 112.903 -178.241 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -60.18 -56.4 22.09 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.2 0.524 . . . . 6.99 110.69 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 421' ' ' PHE . . . . . 0.78 ' HB2' HD21 ' B' ' 418' ' ' ASN . 23.4 m-85 -73.86 -29.27 62.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.081 -0.509 . . . . 7.48 110.415 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 422' ' ' ALA . . . . . 0.453 ' HB3' ' HA ' ' B' ' 419' ' ' ALA . . . -61.4 -46.56 89.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.297 -0.41 . . . . 3.68 110.557 179.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -64.78 -38.52 91.28 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.982 -0.554 . . . . 3.8 110.381 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 1.3 t -70.1 -26.15 63.84 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.13 -0.486 . . . . 5.05 110.503 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 425' ' ' LEU . . . . . 0.474 ' O ' ' HG2' ' B' ' 428' ' ' GLN . 0.5 OUTLIER -79.56 -49.77 11.72 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 116.095 -0.502 . . . . 4.36 111.401 179.961 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.2 pp -61.46 -33.19 73.34 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.132 0.419 . . . . 3.21 112.132 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 427' ' ' PHE . . . . . 0.595 ' CZ ' HG23 ' A' ' 44' ' ' ILE . 1.4 t80 -61.84 -12.51 17.84 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.871 0.693 . . . . 5.27 112.871 -179.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 428' ' ' GLN . . . . . 0.474 ' HG2' ' O ' ' B' ' 425' ' ' LEU . 3.2 pt20 -67.7 -7.53 27.81 Favored 'General case' 0 C--O 1.235 0.314 0 O-C-N 122.216 -0.302 . . . . 5.32 111.51 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.654 -0.689 . . . . 5.11 110.511 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.523 ' HG2' ' O ' ' A' ' 17' ' ' VAL . 23.0 ptt? . . . . . 0 N--CA 1.476 0.859 0 CA-C-O 120.867 0.365 . . . . 1.65 110.492 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . 0.498 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 65.3 mm-40 -87.01 142.4 27.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.935 0.398 . . . . 1.92 111.296 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 27.6 pt -127.58 162.51 32.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.862 -0.608 . . . . 1.48 109.874 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 68.5 m-85 -112.35 117.03 31.34 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.57 -0.287 . . . . 2.17 110.442 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.41 HG21 HD12 ' A' ' 15' ' ' LEU . 36.1 t -106.04 124.65 61.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.439 -0.346 . . . . 1.65 110.375 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -100.37 155.72 17.65 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.213 -0.449 . . . . 3.16 110.762 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.0 p -128.25 169.16 14.51 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.722 -0.844 . . . . 2.17 108.722 178.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 96.2 mt -71.29 -4.38 25.63 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.997 0.369 . . . . 3.05 111.997 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.92 11.75 38.07 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.002 0.43 . . . . 2.7 110.911 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.85 18.47 74.3 Favored Glycine 0 N--CA 1.451 -0.362 0 CA-C-N 115.935 -0.575 . . . . 2.64 112.786 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -95.15 127.0 40.86 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.643 0.259 . . . . 2.34 110.402 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.7 m -107.79 126.34 52.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.345 -0.389 . . . . 2.31 110.11 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.7 mt -116.48 144.76 23.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 116.289 -0.414 . . . . 1.83 110.432 -179.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.33 143.08 30.94 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.94 -0.393 . . . . 2.02 109.94 179.251 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.538 HD11 HG12 ' A' ' 30' ' ' ILE . 59.5 mt -138.96 143.12 38.43 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.702 0.287 . . . . 1.33 111.594 -179.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -97.32 108.79 21.59 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.987 -0.746 . . . . 2.4 108.987 178.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.523 ' O ' ' HG2' ' A' ' 1' ' ' MET . 4.6 m -135.34 168.58 22.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 116.471 -0.331 . . . . 1.25 110.749 -179.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.415 ' O ' HD12 ' A' ' 56' ' ' LEU . 61.1 mm-40 -127.69 159.46 65.99 Favored Pre-proline 0 C--N 1.319 -0.725 0 N-CA-C 109.316 -0.624 . . . . 1.85 109.316 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -52.55 -35.98 69.1 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.79 2.326 . . . . 1.78 112.806 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.56 3.36 22.04 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.74 0.644 . . . . 1.8 112.74 -179.06 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -79.88 138.22 37.11 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.907 -0.317 . . . . 1.23 111.146 -179.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.1 OUTLIER -86.74 147.91 25.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.049 -0.523 . . . . 1.44 110.488 -179.901 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 48.5 mm -56.78 -36.48 49.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-O 120.872 0.367 . . . . 0.99 110.655 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -58.26 -43.44 87.88 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.9 -0.591 . . . . 2.22 109.915 178.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -70.07 -35.83 74.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.74 -0.663 . . . . 1.23 110.323 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 22' ' ' THR . 98.2 t -62.54 -44.41 99.31 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 N-CA-C 109.646 -0.501 . . . . 0.64 109.646 179.123 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -63.21 -34.67 78.15 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.176 -0.466 . . . . 1.32 110.16 179.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.86 -34.79 78.95 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.054 -0.521 . . . . 1.08 109.627 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -68.76 -34.99 76.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.779 -0.646 . . . . 1.08 109.857 178.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.538 HG12 HD11 ' A' ' 15' ' ' LEU . 57.5 mt -72.56 -40.85 63.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 108.86 -0.793 . . . . 1.31 108.86 178.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -60.57 -37.05 80.04 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.599 -0.728 . . . . 1.93 110.626 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -65.13 -30.54 71.47 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.07 -0.514 . . . . 2.05 111.751 -179.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -93.12 -49.25 6.09 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 113.074 0.768 . . . . 2.17 113.074 -178.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 51.5 mm-40 -88.45 -19.34 26.64 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 113.4 0.889 . . . . 2.14 113.4 -177.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.28 24.37 77.04 Favored Glycine 0 N--CA 1.453 -0.202 0 C-N-CA 120.717 -0.754 . . . . 2.01 112.57 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 77.1 mt -99.03 129.82 28.77 Favored Pre-proline 0 C--N 1.327 -0.384 0 O-C-N 122.869 -0.195 . . . . 1.83 110.642 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -52.1 136.39 53.41 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 123.028 2.485 . . . . 2.04 112.493 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -64.84 -15.22 49.2 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.971 2.448 . . . . 1.52 112.902 -179.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -78.76 -26.91 44.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.996 0.427 . . . . 2.95 110.607 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -94.77 -11.15 29.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.215 0.531 . . . . 2.56 110.084 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -78.98 109.9 13.71 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.464 -0.789 . . . . 1.4 111.72 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.566 ' HB3' ' CE2' ' B' ' 427' ' ' PHE . 7.9 mmt180 -111.35 102.16 10.57 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.436 -0.579 . . . . 2.65 109.436 178.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.616 ' HB3' HD12 ' A' ' 50' ' ' LEU . 18.0 mt -88.64 135.21 33.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.157 -0.474 . . . . 1.02 111.759 -179.058 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.758 HD12 ' HB3' ' B' ' 401' ' ' LEU . 0.0 OUTLIER -129.89 150.16 34.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.846 -0.615 . . . . 2.14 110.673 179.571 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.554 ' HB2' HD21 ' A' ' 50' ' ' LEU . 29.6 t80 -133.48 96.04 3.63 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.654 -0.703 . . . . 1.71 109.144 178.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.68 39.81 20.65 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.795 -0.638 . . . . 2.1 111.867 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.23 -16.56 61.05 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.734 -0.746 . . . . 1.84 113.153 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 42.4 mtmt -93.11 114.57 27.13 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 122.821 -0.223 . . . . 3.05 111.157 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -68.35 136.36 53.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.269 -0.423 . . . . 2.3 110.365 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.616 HD12 ' HB3' ' A' ' 43' ' ' LEU . 18.6 mt -92.59 122.74 35.31 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.261 -0.427 . . . . 1.17 111.883 -178.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.7 ' HB2' ' HG2' ' A' ' 54' ' ' ARG . 30.3 mt-10 -80.13 150.02 30.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.1 -0.5 . . . . 2.65 110.475 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -65.54 -33.43 75.9 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.791 -0.64 . . . . 1.83 111.992 -178.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -85.2 17.09 34.89 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.995 -0.622 . . . . 1.82 114.353 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.7 ' HG2' ' HB2' ' A' ' 51' ' ' GLU . 20.3 mmt180 -117.11 165.24 13.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 117.285 0.542 . . . . 2.69 110.868 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 22' ' ' THR . 19.5 p -109.49 177.78 4.64 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.044 -0.525 . . . . 1.71 109.589 178.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.415 HD12 ' O ' ' A' ' 18' ' ' GLU . 75.9 mt -67.22 -36.68 82.2 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.836 0.35 . . . . 1.49 111.111 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.2 m -67.22 -21.76 65.74 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.326 -0.397 . . . . 1.94 111.561 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -67.67 -28.34 67.61 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.544 -0.298 . . . . 2.03 111.247 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -112.58 14.3 20.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.824 0.345 . . . . 1.76 111.058 -179.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 59.32 38.13 23.22 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.723 -0.672 . . . . 2.96 111.455 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 73.7 mt -84.39 107.76 15.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.015 -0.539 . . . . 1.65 109.848 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -101.46 -167.06 1.37 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.87 -0.605 . . . . 2.66 110.58 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.507 ' HB3' ' HB2' ' A' ' 1' ' ' MET . 56.3 pttt -72.4 144.5 48.16 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.693 0.282 . . . . 3.22 111.261 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 68.84 18.87 8.5 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.61 -0.723 . . . . 3.12 112.939 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 51.5 m -76.58 154.74 34.18 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.74 -0.467 . . . . 1.83 109.74 178.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.4 m -105.76 119.55 39.44 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.934 0.397 . . . . 2.03 111.099 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.4 mp -111.34 148.98 31.81 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.671 -0.695 . . . . 1.41 109.193 179.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -116.1 137.56 52.02 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 120.721 0.296 . . . . 2.76 111.188 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 33.4 tp -116.16 115.01 25.25 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.158 -0.474 . . . . 1.54 111.329 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.533 HG23 HD11 ' A' ' 44' ' ' ILE . 39.7 t -105.24 132.58 51.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.995 -0.548 . . . . 1.79 110.091 179.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 78.3 mt -91.26 109.55 20.82 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.448 -0.575 . . . . 2.43 109.448 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.545 ' HG3' ' HA ' ' B' ' 424' ' ' SER . 23.3 ttt180 -92.06 117.69 30.08 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.142 0.496 . . . . 3.19 111.159 -179.702 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.8 mt -89.01 155.89 19.2 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.689 -0.687 . . . . 2.99 110.3 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 74' ' ' ARG . 14.1 mmt180 . . . . . 0 C--N 1.326 -0.444 0 CA-C-O 121.27 0.557 . . . . 3.67 109.979 179.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 390' ' ' PHE . . . . . 0.719 ' HB2' HD11 ' B' ' 395' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.24 0 N-CA-C 110.481 -0.192 . . . . 2.51 110.481 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -64.83 147.63 89.59 Favored 'Trans proline' 0 C--O 1.235 0.361 0 C-N-CA 122.645 2.23 . . . . 3.77 111.349 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -49.86 -59.23 4.04 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 113.588 0.959 . . . . 5.36 113.588 -178.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -48.91 -52.41 24.7 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.554 0.575 . . . . 6.89 112.554 -179.031 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . 0.431 HG22 ' HB2' ' B' ' 419' ' ' ALA . 0.0 OUTLIER -56.09 -43.11 77.74 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.348 -0.387 . . . . 4.2 111.759 -179.467 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 395' ' ' ILE . . . . . 0.719 HD11 ' HB2' ' B' ' 390' ' ' PHE . 75.0 mt -66.16 -51.82 55.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.412 -0.358 . . . . 3.8 110.399 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -57.78 -40.38 79.7 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.961 -0.563 . . . . 6.27 112.099 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 397' ' ' GLN . . . . . 0.438 ' O ' ' HG ' ' B' ' 401' ' ' LEU . 28.1 mm-40 -63.72 -43.52 96.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.932 0.396 . . . . 6.91 110.703 179.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 398' ' ' LEU . . . . . 0.518 HD13 HG23 ' B' ' 408' ' ' VAL . 1.0 OUTLIER -73.98 -33.9 64.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.95 -0.568 . . . . 4.31 111.801 -179.462 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 399' ' ' MET . . . . . 0.47 ' HE1' ' HB ' ' B' ' 408' ' ' VAL . 30.3 mmt -67.12 -40.94 86.9 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.821 0.343 . . . . 5.8 111.269 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -63.76 -24.52 67.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 7.71 112.119 -178.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 401' ' ' LEU . . . . . 0.758 ' HB3' HD12 ' A' ' 44' ' ' ILE . 31.9 mt -63.29 -23.28 67.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.026 0.441 . . . . 5.69 110.879 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 109.78 42.23 1.24 Allowed Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 121.039 -0.6 . . . . 5.87 111.614 -179.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -129.49 153.46 80.65 Favored Pre-proline 0 C--N 1.325 -0.464 0 N-CA-C 110.527 -0.175 . . . . 4.83 110.527 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -83.82 160.07 14.05 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 122.724 2.283 . . . . 4.72 112.612 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.462 ' O ' HG12 ' B' ' 408' ' ' VAL . 23.7 ttt180 -61.04 -30.83 70.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.579 -0.737 . . . . 4.16 110.379 179.512 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -56.68 -43.91 80.91 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.563 -0.744 . . . . 4.69 110.714 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -71.82 -42.09 67.42 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.707 -0.679 . . . . 2.99 112.124 -179.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 408' ' ' VAL . . . . . 0.518 HG23 HD13 ' B' ' 398' ' ' LEU . 4.2 p -61.61 -37.3 77.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 111.989 0.366 . . . . 2.06 111.989 -179.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 71.9 t -68.94 -48.21 71.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.648 0.261 . . . . 2.89 110.79 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 82.5 mttt -61.3 -44.15 97.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.975 0.417 . . . . 5.05 111.167 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -66.0 -49.59 67.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.915 -0.584 . . . . 2.96 111.725 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 45.3 mt -62.49 -32.38 73.28 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.774 0.657 . . . . 3.45 112.774 -179.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 413' ' ' LYS . . . . . 0.452 ' HE2' ' CZ ' ' B' ' 390' ' ' PHE . 61.4 mmtt -69.18 -45.25 70.44 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.923 -0.311 . . . . 5.52 111.721 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 29.0 pt20 -75.28 -26.94 59.15 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.925 0.713 . . . . 5.53 112.925 -178.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 415' ' ' THR . . . . . 0.506 HG21 ' HA ' ' B' ' 422' ' ' ALA . 41.2 p -94.61 -3.28 49.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.084 0.469 . . . . 5.42 111.146 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 61.82 60.85 1.5 Allowed 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.563 0.949 . . . . 6.37 113.563 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 72.03 -24.16 0.7 Allowed Glycine 0 CA--C 1.522 0.5 0 N-CA-C 115.945 1.138 . . . . 4.33 115.945 177.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.37 103.09 2.32 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 122.0 0.905 . . . . 6.25 110.944 -179.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 419' ' ' ALA . . . . . 0.595 ' HA ' ' HB3' ' B' ' 422' ' ' ALA . . . -66.24 -20.66 66.18 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 115.023 -0.989 . . . . 4.12 112.69 -178.231 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -61.69 -50.33 72.9 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.481 0.658 . . . . 6.99 109.305 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -80.46 -27.11 37.96 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.546 -0.752 . . . . 7.48 109.823 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 422' ' ' ALA . . . . . 0.595 ' HB3' ' HA ' ' B' ' 419' ' ' ALA . . . -61.35 -48.09 82.88 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 110.02 -0.363 . . . . 3.68 110.02 178.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.418 ' O ' ' HB2' ' B' ' 427' ' ' PHE . . . -65.68 -40.51 92.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.854 -0.612 . . . . 3.8 109.685 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 424' ' ' SER . . . . . 0.545 ' HA ' ' HG3' ' A' ' 72' ' ' ARG . 21.6 m -61.41 -39.39 90.56 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.749 -0.659 . . . . 5.05 111.069 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.69 -46.84 23.99 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.291 -0.413 . . . . 4.36 110.979 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.3 -37.06 76.77 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.988 0.366 . . . . 3.21 111.988 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 427' ' ' PHE . . . . . 0.566 ' CE2' ' HB3' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -77.25 3.15 13.58 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 113.621 0.971 . . . . 5.27 113.621 -178.683 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -56.94 -20.98 26.54 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.251 0.463 . . . . 5.32 112.251 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 14.2 m . . . . . 0 C--O 1.251 1.134 0 CA-C-O 118.61 -0.709 . . . . 5.11 111.328 -179.777 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.456 ' HG2' ' O ' ' A' ' 17' ' ' VAL . 20.8 ptt? . . . . . 0 N--CA 1.481 1.094 0 CA-C-O 120.577 0.227 . . . . 1.65 110.423 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -109.28 138.17 46.04 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 111.967 0.358 . . . . 1.92 111.967 -179.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 16.0 pt -130.32 159.38 42.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.779 -0.646 . . . . 1.48 109.534 178.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -121.03 123.65 42.91 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.75 0.309 . . . . 2.17 110.574 -179.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.4 t -105.42 127.22 60.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.451 -0.34 . . . . 1.65 111.008 -179.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.1 mmtp -92.65 128.3 38.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.282 -0.417 . . . . 3.16 110.829 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.436 HG23 HD23 ' A' ' 69' ' ' LEU . 0.2 OUTLIER -105.06 164.76 11.56 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.224 -0.444 . . . . 2.17 110.751 179.796 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.402 ' HA ' HD23 ' A' ' 8' ' ' LEU . 10.5 mt -64.12 -15.56 59.95 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.413 0.523 . . . . 3.05 112.413 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -90.79 5.23 49.19 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.936 0.398 . . . . 2.7 110.632 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.13 3.97 90.58 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.858 -0.687 . . . . 2.64 111.416 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -75.11 148.41 39.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.413 -0.393 . . . . 2.34 111.037 -179.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.9 m -119.3 108.19 14.31 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.802 -0.814 . . . . 2.31 108.802 178.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 17.9 mt -92.49 126.51 44.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.33 -0.396 . . . . 1.83 111.466 -178.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.0 122.6 34.66 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.196 -0.668 . . . . 2.02 109.196 178.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 76.2 mt -122.25 137.94 54.66 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 112.429 0.529 . . . . 1.33 112.429 -178.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -90.78 108.5 19.87 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.259 -1.015 . . . . 2.4 108.259 178.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.456 ' O ' ' HG2' ' A' ' 1' ' ' MET . 10.9 m -139.49 173.82 10.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.048 0.451 . . . . 1.25 111.056 -178.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 36.5 mm-40 -138.93 157.31 71.8 Favored Pre-proline 0 C--N 1.32 -0.708 0 N-CA-C 107.923 -1.14 . . . . 1.85 107.923 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.772 ' HA ' ' HB2' ' A' ' 56' ' ' LEU . 88.2 Cg_exo -50.1 -33.04 33.73 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.749 2.299 . . . . 1.78 112.883 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.5 m -74.36 -10.17 59.32 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.799 0.666 . . . . 1.8 112.799 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -77.33 135.46 38.38 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.85 -0.426 . . . . 1.23 109.85 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -86.16 150.12 24.63 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.538 -0.301 . . . . 1.44 110.945 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.421 HG13 ' HB3' ' A' ' 50' ' ' LEU . 43.5 mm -55.66 -36.06 41.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-O 121.033 0.444 . . . . 0.99 110.427 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.447 ' HB2' ' HB3' ' A' ' 52' ' ' ASP . 20.4 tt0 -59.42 -41.37 89.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.581 -0.736 . . . . 2.22 110.695 179.417 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -71.6 -34.84 70.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.032 -0.531 . . . . 1.23 110.679 -179.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.8 t -60.62 -42.61 92.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.069 -0.514 . . . . 0.64 109.725 179.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.522 ' HG2' HD12 ' A' ' 43' ' ' LEU . 37.2 mtmt -62.74 -36.39 82.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.926 -0.579 . . . . 1.32 110.63 179.37 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.45 -35.54 80.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.985 -0.552 . . . . 1.08 110.55 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -67.74 -37.34 82.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.018 -0.537 . . . . 1.08 109.909 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 54.2 mt -70.99 -33.05 50.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.027 -0.533 . . . . 1.31 110.196 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.741 ' HG3' ' HD3' ' A' ' 38' ' ' PRO . 1.7 tt0 -64.84 -34.6 78.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.943 -0.571 . . . . 1.93 110.803 179.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -81.18 -36.2 30.45 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.291 -0.413 . . . . 2.05 111.157 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 75.6 mttt -76.48 -55.38 5.58 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.399 0.518 . . . . 2.17 112.399 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 55.7 mm-40 -85.74 -42.29 14.35 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.118 0.414 . . . . 2.14 112.118 -178.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 105.55 8.05 35.81 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.614 -0.803 . . . . 2.01 111.361 -179.097 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 24.9 mt -89.58 121.09 69.5 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.73 -0.47 . . . . 1.83 109.73 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.463 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 55.1 Cg_exo -54.39 135.32 65.26 Favored 'Trans proline' 0 C--N 1.342 0.231 0 C-N-CA 122.907 2.405 . . . . 2.04 111.409 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.741 ' HD3' ' HG3' ' A' ' 31' ' ' GLN . 32.2 Cg_exo -59.23 -22.39 64.65 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 123.302 2.668 . . . . 1.52 112.373 -179.045 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -77.4 -23.21 50.7 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.928 -0.578 . . . . 2.95 110.882 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -102.56 7.74 40.0 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.119 0.485 . . . . 2.56 110.634 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -91.34 176.16 6.66 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.472 -0.785 . . . . 1.4 110.475 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.458 ' O ' ' HA ' ' A' ' 69' ' ' LEU . 0.0 OUTLIER -160.37 94.51 1.08 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.85 -0.796 . . . . 2.65 108.85 179.38 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.522 HD12 ' HG2' ' A' ' 27' ' ' LYS . 16.8 mt -100.18 123.19 44.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.094 0.473 . . . . 1.02 112.263 -178.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.667 HG22 ' HA ' ' A' ' 49' ' ' GLN . 20.0 pt -132.78 163.07 38.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.706 -0.679 . . . . 2.14 109.687 178.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.45 ' CB ' HD21 ' A' ' 50' ' ' LEU . 74.7 t80 -130.09 112.74 13.72 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.465 -0.334 . . . . 1.71 110.281 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.58 35.11 22.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.791 -0.641 . . . . 2.1 111.98 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.3 -17.67 56.57 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.771 -0.728 . . . . 1.84 113.249 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -95.39 126.27 40.58 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.112 -0.329 . . . . 3.05 110.112 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.667 ' HA ' HG22 ' A' ' 44' ' ' ILE . 0.9 OUTLIER -67.14 151.08 48.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.054 0.454 . . . . 2.3 111.705 -178.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.45 HD21 ' CB ' ' A' ' 45' ' ' PHE . 18.9 mt -108.64 132.52 53.82 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.574 -0.739 . . . . 1.17 110.206 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.783 ' HB2' ' HG2' ' A' ' 54' ' ' ARG . 46.9 mt-10 -86.85 146.78 26.08 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.401 -0.363 . . . . 2.65 110.667 179.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.447 ' HB3' ' HB2' ' A' ' 24' ' ' GLU . 9.0 m-20 -61.76 -34.76 76.43 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 112.713 0.634 . . . . 1.83 112.713 -178.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -85.12 14.23 50.56 Favored Glycine 0 N--CA 1.453 -0.217 0 C-N-CA 120.962 -0.637 . . . . 1.82 113.043 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.783 ' HG2' ' HB2' ' A' ' 51' ' ' GLU . 30.1 mmt180 -112.45 152.0 29.23 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.027 0.441 . . . . 2.69 110.456 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.501 ' HB ' ' O ' ' A' ' 19' ' ' PRO . 68.4 p -99.19 175.26 5.95 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 108.891 -0.781 . . . . 1.71 108.891 179.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.772 ' HB2' ' HA ' ' A' ' 19' ' ' PRO . 88.0 mt -68.93 -31.54 70.5 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.357 -0.608 . . . . 1.49 109.357 178.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.89 -28.53 68.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.555 -0.748 . . . . 1.94 110.632 178.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' A' ' 55' ' ' THR . 2.4 m-20 -60.34 -32.41 71.23 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.112 -0.495 . . . . 2.03 111.118 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -108.82 12.0 25.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.233 -0.44 . . . . 1.76 111.58 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 61.4 30.21 18.85 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.911 -0.586 . . . . 2.96 111.707 -179.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.453 ' HB ' ' HB3' ' A' ' 56' ' ' LEU . 86.4 mt -74.42 116.59 17.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 109.375 -0.602 . . . . 1.65 109.375 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -109.5 -163.24 0.85 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.953 -0.567 . . . . 2.66 110.306 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.9 pttt -73.86 149.43 41.56 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.677 -0.238 . . . . 3.22 110.815 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 69.41 19.15 7.72 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.711 0.634 . . . . 3.12 112.711 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.417 ' HB3' ' HE1' ' A' ' 45' ' ' PHE . 20.3 m -82.3 146.76 29.26 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.784 0.326 . . . . 1.83 110.328 179.265 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 10.3 m -105.33 120.9 42.72 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.045 0.45 . . . . 2.03 111.539 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.5 mp -102.62 147.27 27.0 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.7 -0.682 . . . . 1.41 109.461 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.57 ' HB2' ' CG1' ' A' ' 44' ' ' ILE . 23.9 m80 -105.57 129.78 53.76 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.579 -0.282 . . . . 2.76 110.936 -179.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.458 ' HA ' ' O ' ' A' ' 42' ' ' ARG . 29.1 tp -123.4 121.86 36.82 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.254 -0.43 . . . . 1.54 110.781 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.651 HG22 ' HB1' ' B' ' 423' ' ' ALA . 0.5 OUTLIER -116.88 153.41 18.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.311 -0.404 . . . . 1.79 110.917 179.612 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 95.9 mt -85.89 131.23 34.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.077 0.465 . . . . 2.43 111.203 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.561 ' HA ' ' HB3' ' B' ' 424' ' ' SER . 12.1 ttt180 -106.16 80.01 1.46 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.858 -0.61 . . . . 3.19 109.501 178.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.622 HD11 ' HB3' ' B' ' 420' ' ' GLU . 77.6 mt -63.18 150.06 43.86 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.726 -0.67 . . . . 2.99 111.417 -179.503 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 74' ' ' ARG . 14.5 mmt85 . . . . . 0 C--N 1.322 -0.598 0 CA-C-N 116.072 -0.513 . . . . 3.67 110.087 179.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 390' ' ' PHE . . . . . 0.768 ' HB3' HD11 ' B' ' 395' ' ' ILE . 57.4 m-85 . . . . . 0 N--CA 1.455 -0.203 0 N-CA-C 110.228 -0.286 . . . . 2.51 110.228 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_exo -72.67 121.09 7.1 Favored 'Trans proline' 0 C--O 1.235 0.347 0 C-N-CA 123.054 2.503 . . . . 3.77 111.968 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 392' ' ' GLU . . . . . 0.634 ' HB3' ' HE3' ' B' ' 396' ' ' LYS . 18.4 mt-10 -51.19 -50.34 59.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.873 -0.603 . . . . 5.36 112.514 -179.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -55.16 -50.12 70.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.025 -0.534 . . . . 6.89 111.918 -179.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 2.1 m -61.18 -45.18 95.67 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.032 -0.531 . . . . 4.2 111.29 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 395' ' ' ILE . . . . . 0.768 HD11 ' HB3' ' B' ' 390' ' ' PHE . 75.0 mt -60.64 -48.71 87.48 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.109 0 CA-C-O 120.662 0.268 . . . . 3.8 110.848 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 396' ' ' LYS . . . . . 0.634 ' HE3' ' HB3' ' B' ' 392' ' ' GLU . 73.3 mttt -58.28 -41.27 84.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 6.27 111.925 -179.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -68.33 -36.8 79.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.841 0.353 . . . . 6.91 110.723 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 83.4 mt -68.43 -24.28 64.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.285 -0.416 . . . . 4.31 111.051 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 399' ' ' MET . . . . . 0.615 ' HG2' ' O ' ' B' ' 395' ' ' ILE . 23.1 mmt -68.36 -25.11 64.92 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.04 0.448 . . . . 5.8 110.63 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -73.96 -11.43 60.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.886 -0.597 . . . . 7.71 111.416 -179.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 74.9 mt -86.03 16.96 3.79 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.035 0.383 . . . . 5.69 112.035 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 62.53 47.3 90.36 Favored Glycine 0 CA--C 1.518 0.227 0 C-N-CA 121.07 -0.586 . . . . 5.87 112.589 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -134.51 150.3 73.36 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-O 120.361 0.124 . . . . 4.83 110.802 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 404' ' ' PRO . . . . . 0.466 ' HG2' ' HB2' ' B' ' 407' ' ' ALA . 52.4 Cg_endo -69.49 153.35 70.29 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.955 2.437 . . . . 4.72 112.204 179.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.467 ' HA ' ' HE3' ' B' ' 399' ' ' MET . 25.9 ttt180 -68.76 -41.0 79.47 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.123 0.416 . . . . 4.16 112.123 -178.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -59.6 -37.31 78.24 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.405 -0.361 . . . . 4.69 111.527 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 407' ' ' ALA . . . . . 0.466 ' HB2' ' HG2' ' B' ' 404' ' ' PRO . . . -61.72 -39.38 91.3 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.244 -0.434 . . . . 2.99 110.518 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 55.2 t -66.09 -40.75 88.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.85 -0.614 . . . . 2.06 110.11 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 88.6 t -60.24 -46.01 95.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.033 -0.531 . . . . 2.89 110.189 179.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 19.2 mttp -67.69 -39.3 84.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.984 -0.553 . . . . 5.05 111.155 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -65.81 -49.2 69.12 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.181 -0.463 . . . . 2.96 111.309 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 46.5 mt -63.63 -30.7 71.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.452 -0.34 . . . . 3.45 111.375 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -64.66 -49.06 72.48 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.32 -0.4 . . . . 5.52 111.041 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -80.05 -9.73 59.72 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.207 0.817 . . . . 5.53 113.207 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 31.4 p -107.75 -4.99 17.59 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.759 0.314 . . . . 5.42 110.96 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 55.1 m-80 64.91 55.4 1.19 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.857 -0.611 . . . . 6.37 112.501 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 72.71 -6.94 10.05 Favored Glycine 0 CA--C 1.519 0.287 0 CA-C-N 115.864 -0.607 . . . . 4.33 114.253 178.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -67.8 93.99 0.43 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.018 0.437 . . . . 6.25 110.15 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -59.08 -35.88 74.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.527 -0.76 . . . . 4.12 112.287 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 420' ' ' GLU . . . . . 0.622 ' HB3' HD11 ' A' ' 73' ' ' LEU . 12.7 mt-10 -71.94 -43.79 64.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.883 0.373 . . . . 6.99 110.674 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -67.78 -39.68 84.04 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.189 -0.46 . . . . 7.48 109.861 179.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -61.73 -38.99 89.99 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.779 -0.646 . . . . 3.68 110.436 179.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.651 ' HB1' HG22 ' A' ' 70' ' ' VAL . . . -57.3 -48.8 77.99 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.009 -0.541 . . . . 3.8 110.613 179.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 424' ' ' SER . . . . . 0.561 ' HB3' ' HA ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -63.12 -30.88 71.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.053 -0.521 . . . . 5.05 111.612 179.123 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 425' ' ' LEU . . . . . 0.598 ' O ' ' HG2' ' B' ' 428' ' ' GLN . 3.4 mm? -81.82 -50.25 9.44 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 113.747 1.017 . . . . 4.36 113.747 -178.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.3 pp -62.63 -34.25 76.66 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.126 0.788 . . . . 3.21 113.126 -178.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 427' ' ' PHE . . . . . 0.442 ' HD2' ' HG2' ' A' ' 42' ' ' ARG . 2.0 m-85 -67.04 -13.03 61.52 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.341 0.867 . . . . 5.27 113.341 -179.467 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 428' ' ' GLN . . . . . 0.598 ' HG2' ' O ' ' B' ' 425' ' ' LEU . 0.0 OUTLIER -77.39 -18.63 57.15 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 120.809 -0.356 . . . . 5.32 111.811 -179.779 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 6.6 m . . . . . 0 C--O 1.247 0.954 0 CA-C-O 118.676 -0.678 . . . . 5.11 110.9 -179.372 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.5 ' HB2' ' HB3' ' A' ' 63' ' ' LYS . 26.0 ptt? . . . . . 0 N--CA 1.481 1.099 0 N-CA-C 110.204 -0.295 . . . . 1.65 110.204 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . 0.858 HE22 ' HG2' ' A' ' 16' ' ' GLU . 89.2 mm-40 -102.27 135.33 44.06 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.914 0.388 . . . . 1.92 111.582 -179.42 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.3 pt -126.63 151.93 33.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.027 -0.533 . . . . 1.48 109.916 178.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -108.93 124.75 51.16 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.673 -0.239 . . . . 2.17 111.167 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.1 t -111.8 118.83 58.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.42 -0.585 . . . . 1.65 109.42 179.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -102.09 132.68 47.81 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.0 0.429 . . . . 3.16 111.727 -179.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.404 ' OG1' ' HB3' ' A' ' 11' ' ' LYS . 26.5 p -99.06 175.85 5.77 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.959 -0.564 . . . . 2.17 110.224 179.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.476 HD21 HG22 ' A' ' 70' ' ' VAL . 92.8 mt -79.28 10.61 3.52 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.914 0.388 . . . . 3.05 111.7 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -110.04 3.52 20.43 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.318 -0.401 . . . . 2.7 110.71 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 80.18 24.88 58.62 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.796 -0.716 . . . . 2.64 111.783 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.662 ' HE2' HG12 ' A' ' 13' ' ' ILE . 81.5 tttt -106.35 134.88 48.79 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.584 0.23 . . . . 2.34 110.499 -179.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.1 m -115.64 109.48 17.81 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.961 0.41 . . . . 2.31 110.755 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.662 HG12 ' HE2' ' A' ' 11' ' ' LYS . 7.5 mt -95.26 138.48 20.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.893 -0.594 . . . . 1.83 110.428 -179.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.5 m -101.94 115.09 29.78 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.761 -0.459 . . . . 2.02 109.761 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.434 HD11 HG12 ' A' ' 30' ' ' ILE . 55.1 mt -105.07 143.32 33.41 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.059 0.456 . . . . 1.33 112.124 -179.078 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.858 ' HG2' HE22 ' A' ' 2' ' ' GLN . 14.9 mt-10 -98.97 101.51 12.93 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.46 -0.791 . . . . 2.4 109.609 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 16.3 m -138.2 -179.0 2.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.991 -0.549 . . . . 1.25 110.821 -178.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.418 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 27.4 mm-40 -132.78 157.72 77.62 Favored Pre-proline 0 C--N 1.323 -0.584 0 N-CA-C 109.035 -0.728 . . . . 1.85 109.035 179.098 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.583 ' HA ' ' HB2' ' A' ' 56' ' ' LEU . 74.6 Cg_exo -53.34 -29.67 48.95 Favored 'Trans proline' 0 CA--C 1.533 0.467 0 C-N-CA 122.882 2.388 . . . . 1.78 113.058 -179.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.98 -5.48 48.8 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.14 0.422 . . . . 1.8 112.14 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.418 ' HB2' ' O ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -74.07 144.04 45.18 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.029 0.442 . . . . 1.23 110.757 -179.693 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -93.48 145.13 24.73 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.798 -0.637 . . . . 1.44 110.075 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.559 HG23 HD12 ' A' ' 43' ' ' LEU . 46.1 mm -53.34 -42.77 49.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 O-C-N 123.166 0.291 . . . . 0.99 111.469 -179.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -56.59 -44.34 80.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.366 -0.379 . . . . 2.22 110.7 179.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.483 ' O ' ' HG3' ' A' ' 29' ' ' LYS . 66.5 t30 -67.27 -37.31 83.26 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.961 -0.563 . . . . 1.23 110.667 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 87.2 t -61.37 -43.49 96.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.086 -0.506 . . . . 0.64 110.462 179.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.8 mtmt -63.33 -34.17 77.12 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.209 -0.451 . . . . 1.32 110.976 179.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -64.96 -32.81 74.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.086 -0.506 . . . . 1.08 110.132 179.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 21.4 mttt -71.04 -37.43 72.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.009 -0.542 . . . . 1.08 109.827 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.434 HG12 HD11 ' A' ' 15' ' ' LEU . 59.3 mt -66.77 -38.23 81.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 109.084 -0.71 . . . . 1.31 109.084 178.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -65.63 -37.34 86.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.753 -0.658 . . . . 1.93 110.596 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -67.72 -37.17 81.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.219 -0.446 . . . . 2.05 112.019 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -87.3 -54.48 4.28 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 113.046 0.758 . . . . 2.17 113.046 -178.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -77.36 -35.85 54.16 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.702 0.63 . . . . 2.14 112.702 -178.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 91.57 13.77 57.83 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.454 -0.879 . . . . 2.01 111.835 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.0 mt -95.17 123.77 56.01 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 110.075 -0.343 . . . . 1.83 110.075 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -52.98 137.81 61.84 Favored 'Trans proline' 0 CA--C 1.532 0.378 0 C-N-CA 123.083 2.522 . . . . 2.04 112.33 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -62.57 -18.7 64.99 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.943 2.429 . . . . 1.52 111.974 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -71.13 -25.4 62.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.953 -0.567 . . . . 2.95 110.238 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -102.15 6.65 40.91 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.043 -0.526 . . . . 2.56 110.368 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.507 ' HB3' HD11 ' A' ' 69' ' ' LEU . 75.5 mt-30 -98.6 114.95 27.61 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.924 -0.58 . . . . 1.4 111.661 -179.152 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.418 ' HD2' ' HB2' ' A' ' 72' ' ' ARG . 66.6 mtp180 -116.59 101.59 8.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.241 -0.436 . . . . 2.65 109.979 178.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.559 HD12 HG23 ' A' ' 23' ' ' ILE . 21.7 mt -77.33 128.26 33.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.894 0.378 . . . . 1.02 111.26 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.436 HD13 ' HZ ' ' B' ' 403' ' ' PHE . 53.5 mt -124.88 137.63 56.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.669 -0.696 . . . . 2.14 110.772 -179.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.48 ' HB3' HD21 ' A' ' 50' ' ' LEU . 40.4 t80 -132.7 113.22 12.73 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.038 -0.727 . . . . 1.71 109.038 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 63.16 30.36 16.01 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.22 -0.446 . . . . 2.1 112.01 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 86.04 4.06 84.7 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.871 -0.681 . . . . 1.84 113.089 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 41.6 mtmt -116.49 136.75 52.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.766 0.283 . . . . 3.05 110.906 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.571 ' HB2' ' CZ ' ' B' ' 427' ' ' PHE . 8.1 tt0 -73.6 145.87 45.1 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.199 -0.455 . . . . 2.3 110.529 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.48 HD21 ' HB3' ' A' ' 45' ' ' PHE . 26.1 mt -105.33 140.4 38.52 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.297 -0.41 . . . . 1.17 110.594 179.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.59 ' HB2' ' CG ' ' A' ' 54' ' ' ARG . 43.5 mt-10 -80.47 138.41 36.57 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.715 -0.476 . . . . 2.65 109.715 179.199 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.457 ' HA ' ' HB ' ' A' ' 23' ' ' ILE . 71.0 m-20 -64.77 -28.37 69.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.948 0.404 . . . . 1.83 111.06 -179.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -86.37 22.85 11.23 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 115.82 -0.627 . . . . 1.82 112.808 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.59 ' CG ' ' HB2' ' A' ' 51' ' ' GLU . 37.0 mmt180 -120.86 160.83 22.62 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.911 -0.403 . . . . 2.69 109.911 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.517 ' O ' ' HB2' ' A' ' 58' ' ' ASP . 35.2 p -103.8 174.44 5.87 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.922 -0.399 . . . . 1.71 109.922 179.287 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.583 ' HB2' ' HA ' ' A' ' 19' ' ' PRO . 85.8 mt -66.86 -35.99 81.31 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.168 0.508 . . . . 1.49 110.346 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.4 m -65.88 -21.85 66.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.828 -0.624 . . . . 1.94 110.339 178.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.517 ' HB2' ' O ' ' A' ' 55' ' ' THR . 4.7 m-20 -68.14 -21.51 64.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.784 -0.644 . . . . 2.03 112.158 -179.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -120.98 16.48 11.7 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.705 0.288 . . . . 1.76 111.271 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 60.99 28.71 18.49 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.729 -0.669 . . . . 2.96 111.617 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 67.2 mt -78.76 114.53 19.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.212 -0.449 . . . . 1.65 110.658 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -107.92 -165.99 1.1 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.753 -0.658 . . . . 2.66 110.117 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.709 ' HD2' ' HG3' ' A' ' 64' ' ' GLU . 0.1 OUTLIER -73.77 152.57 40.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.695 -0.23 . . . . 3.22 110.985 -179.905 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.709 ' HG3' ' HD2' ' A' ' 63' ' ' LYS . 46.6 mt-10 73.16 1.7 4.1 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 112.688 0.625 . . . . 3.12 112.688 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.0 m -74.06 146.24 43.83 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.755 0.312 . . . . 1.83 110.963 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.0 m -108.93 129.13 55.42 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.814 0.34 . . . . 2.03 111.192 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.2 mp -115.97 152.44 33.49 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.81 -0.811 . . . . 1.41 108.81 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 70.5 m80 -111.04 150.54 29.19 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.645 0.259 . . . . 2.76 111.193 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.507 HD11 ' HB3' ' A' ' 41' ' ' GLN . 23.2 tp -129.84 109.79 11.21 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.314 -0.403 . . . . 1.54 111.245 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.476 HG22 HD21 ' A' ' 8' ' ' LEU . 16.0 t -96.18 126.87 48.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 109.901 -0.407 . . . . 1.79 109.901 179.016 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 63.9 mt -74.46 112.34 10.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.947 -0.57 . . . . 2.43 109.903 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.432 ' HA ' ' OG ' ' B' ' 424' ' ' SER . 29.3 ttt180 -85.37 103.25 14.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.119 -0.491 . . . . 3.19 111.236 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 77.9 mt -73.77 126.25 29.95 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.007 -0.542 . . . . 2.99 109.796 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 74' ' ' ARG . 11.3 mmt180 . . . . . 0 C--N 1.324 -0.514 0 CA-C-O 120.89 0.376 . . . . 3.67 111.398 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 390' ' ' PHE . . . . . 0.619 ' HB3' ' HG ' ' B' ' 412' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.451 -0.383 0 CA-C-O 120.721 0.296 . . . . 2.51 110.884 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -64.77 141.56 72.5 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.656 2.237 . . . . 3.77 111.137 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 392' ' ' GLU . . . . . 0.61 ' O ' ' HG2' ' B' ' 396' ' ' LYS . 2.9 mm-40 -53.96 -41.08 67.41 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.605 0.594 . . . . 5.36 112.605 -179.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 393' ' ' GLN . . . . . 0.423 HE21 ' HB3' ' B' ' 393' ' ' GLN . 5.6 tt0 -55.37 -52.58 63.07 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.932 0.396 . . . . 6.89 111.72 -179.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.44 -36.67 83.15 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.195 -0.457 . . . . 4.2 110.974 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 395' ' ' ILE . . . . . 0.45 ' O ' ' HG2' ' B' ' 399' ' ' MET . 93.1 mt -63.17 -42.37 96.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.075 -0.512 . . . . 3.8 110.317 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 396' ' ' LYS . . . . . 0.61 ' HG2' ' O ' ' B' ' 392' ' ' GLU . 24.1 mmtp -58.61 -41.2 85.31 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.481 -0.327 . . . . 6.27 110.913 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -63.48 -41.71 98.57 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.151 -0.477 . . . . 6.91 110.794 179.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 77.8 mt -73.44 -27.92 61.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.056 -0.52 . . . . 4.31 111.646 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 399' ' ' MET . . . . . 0.45 ' HG2' ' O ' ' B' ' 395' ' ' ILE . 31.4 mmt -67.62 -41.9 83.22 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.425 -0.352 . . . . 5.8 111.17 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -61.51 -24.39 66.57 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.118 -0.492 . . . . 7.71 111.699 -179.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 44.9 mt -68.93 -17.5 63.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 5.69 111.0 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 90.93 34.66 7.56 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.719 -0.753 . . . . 5.87 112.36 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 403' ' ' PHE . . . . . 0.436 ' HZ ' HD13 ' A' ' 44' ' ' ILE . 21.2 m-85 -113.8 149.88 42.5 Favored Pre-proline 0 C--N 1.325 -0.47 0 N-CA-C 110.531 -0.174 . . . . 4.83 110.531 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -67.03 142.62 62.46 Favored 'Trans proline' 0 CA--C 1.531 0.329 0 C-N-CA 122.474 2.116 . . . . 4.72 111.9 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -65.35 -33.81 76.83 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.394 -0.366 . . . . 4.16 111.447 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -62.56 -38.69 91.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.266 -0.424 . . . . 4.69 110.764 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -65.34 -33.94 77.14 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.163 0.506 . . . . 2.99 109.678 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 54.0 t -63.99 -41.73 93.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.347 -0.842 . . . . 2.06 109.432 179.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 409' ' ' VAL . . . . . 0.477 HG13 ' CZ ' ' B' ' 390' ' ' PHE . 88.0 t -59.93 -47.57 91.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.916 -0.584 . . . . 2.89 110.276 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 34.3 mttp -60.3 -47.5 85.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.663 -0.698 . . . . 5.05 111.079 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -67.18 -44.91 78.5 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.746 -0.661 . . . . 2.96 111.96 -178.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.619 ' HG ' ' HB3' ' B' ' 390' ' ' PHE . 2.6 mm? -63.93 -31.26 72.39 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.94 0.348 . . . . 3.45 111.94 -179.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 413' ' ' LYS . . . . . 0.413 ' HA ' ' HD3' ' B' ' 413' ' ' LYS . 32.3 mmtt -71.58 -45.91 60.85 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.801 0.297 . . . . 5.52 111.801 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -72.05 -27.82 62.94 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.196 0.443 . . . . 5.53 112.196 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 415' ' ' THR . . . . . 0.778 ' HB ' ' HB2' ' B' ' 418' ' ' ASN . 39.5 p -92.4 -14.48 28.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.816 0.341 . . . . 5.42 111.238 -179.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 59.81 62.42 1.69 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 113.039 0.755 . . . . 6.37 113.039 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 86.33 -12.21 61.25 Favored Glycine 0 CA--C 1.518 0.248 0 C-N-CA 120.523 -0.846 . . . . 4.33 114.051 178.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 418' ' ' ASN . . . . . 0.778 ' HB2' ' HB ' ' B' ' 415' ' ' THR . 33.4 m-80 -73.43 79.76 1.4 Allowed 'General case' 0 C--N 1.321 -0.668 0 O-C-N 122.348 -0.501 . . . . 6.25 110.117 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -58.62 -42.32 87.95 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.155 -0.475 . . . . 4.12 112.135 -179.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -65.11 -37.71 88.33 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.295 0.569 . . . . 6.99 110.542 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -73.34 -38.16 65.86 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.659 -0.7 . . . . 7.48 109.163 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -61.88 -42.65 99.31 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.549 -0.751 . . . . 3.68 110.408 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -58.93 -42.11 88.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.129 0.49 . . . . 3.8 110.09 179.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 424' ' ' SER . . . . . 0.432 ' OG ' ' HA ' ' A' ' 72' ' ' ARG . 71.6 m -70.49 -37.86 74.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.85 -0.614 . . . . 5.05 110.867 179.15 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -71.38 -48.85 47.44 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 113.058 0.762 . . . . 4.36 113.058 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.6 pp -67.3 -34.51 77.52 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.154 0.427 . . . . 3.21 112.154 -178.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 427' ' ' PHE . . . . . 0.571 ' CZ ' ' HB2' ' A' ' 49' ' ' GLN . 3.4 t80 -89.08 1.62 55.31 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.216 0.45 . . . . 5.27 112.216 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -59.9 -19.67 52.9 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.842 0.353 . . . . 5.32 111.698 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 41.0 m . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.244 -0.884 . . . . 5.11 109.981 179.237 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.403 ' HB2' ' HB3' ' A' ' 63' ' ' LYS . 25.0 ptt? . . . . . 0 N--CA 1.483 1.183 0 N-CA-C 110.092 -0.336 . . . . 1.65 110.092 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 77.1 mm-40 -107.42 138.68 43.18 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.659 0.266 . . . . 1.92 110.71 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 32.3 pt -124.15 163.64 23.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.439 -0.346 . . . . 1.48 110.092 179.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -117.65 122.79 44.52 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.787 0.327 . . . . 2.17 110.914 -179.593 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 56.1 t -106.74 122.39 60.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.287 -0.415 . . . . 1.65 109.988 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -109.52 137.33 47.52 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.197 0.523 . . . . 3.16 111.395 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.27 159.08 16.91 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.675 -0.693 . . . . 2.17 109.554 179.298 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.471 HD21 HD11 ' B' ' 401' ' ' LEU . 55.8 mt -64.57 -6.84 8.4 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.112 0.412 . . . . 3.05 112.112 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.9 p -88.96 -10.52 47.43 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.058 0.456 . . . . 2.7 110.338 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.47 -9.02 52.78 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.97 -0.559 . . . . 2.64 112.19 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -68.18 143.6 55.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.873 0.368 . . . . 2.34 111.514 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.7 m -136.3 111.6 9.11 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.457 -0.571 . . . . 2.31 109.457 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.5 mt -112.43 148.69 15.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.534 -0.303 . . . . 1.83 110.717 -178.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 7.9 m -96.83 142.41 28.86 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.298 -0.63 . . . . 2.02 109.298 178.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 17.9 mt -133.41 131.19 39.68 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.843 0.354 . . . . 1.33 111.464 179.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -85.99 109.45 18.79 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.786 -0.643 . . . . 2.4 109.316 178.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.719 HG12 ' HE3' ' A' ' 29' ' ' LYS . 16.8 m -134.0 -169.8 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.93 -0.577 . . . . 1.25 110.732 -179.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.441 ' O ' HD12 ' A' ' 56' ' ' LEU . 11.7 mm-40 -153.26 153.96 30.11 Favored Pre-proline 0 C--N 1.322 -0.621 0 N-CA-C 107.408 -1.33 . . . . 1.85 107.408 178.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_exo -53.64 -31.67 61.19 Favored 'Trans proline' 0 CA--C 1.528 0.199 0 C-N-CA 122.208 1.939 . . . . 1.78 112.122 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.5 1.42 22.41 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.046 0.758 . . . . 1.8 113.046 -179.055 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -89.0 137.79 31.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.83 0.347 . . . . 1.23 110.161 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.0 OUTLIER -83.07 154.2 24.51 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.247 -0.433 . . . . 1.44 111.084 -179.467 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 34.3 mm -56.3 -41.32 70.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.369 -0.378 . . . . 0.99 110.9 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -57.45 -37.47 72.9 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.108 -0.496 . . . . 2.22 110.677 179.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -67.81 -32.5 73.1 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.076 -0.511 . . . . 1.23 110.435 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.549 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 46.2 t -69.28 -40.68 80.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 108.91 -0.774 . . . . 0.64 108.91 178.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.566 ' HE3' ' HB2' ' A' ' 41' ' ' GLN . 6.7 mmmm -59.03 -43.28 91.6 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.527 -0.761 . . . . 1.32 109.871 179.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.01 -41.44 96.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.485 -0.78 . . . . 1.08 110.7 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.719 ' HE3' HG12 ' A' ' 17' ' ' VAL . 28.4 mtmm -65.11 -36.84 85.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.008 -0.542 . . . . 1.08 110.944 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.408 HG13 ' O ' ' A' ' 26' ' ' VAL . 81.7 mt -66.48 -38.06 80.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 109.973 -0.38 . . . . 1.31 109.973 178.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -68.7 -31.8 71.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.036 0.446 . . . . 1.93 110.481 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -74.64 -22.98 58.61 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.843 0.354 . . . . 2.05 111.28 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -97.45 -43.52 7.24 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.216 0.45 . . . . 2.17 112.216 -179.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 53.7 mm-40 -98.12 -31.27 12.2 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.131 0.789 . . . . 2.14 113.131 -178.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 91.75 5.47 66.52 Favored Glycine 0 C--N 1.324 -0.134 0 C-N-CA 120.533 -0.841 . . . . 2.01 112.152 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 65.7 mt -84.96 125.09 71.52 Favored Pre-proline 0 C--N 1.328 -0.362 0 N-CA-C 110.395 -0.224 . . . . 1.83 110.395 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_exo -55.09 140.93 80.55 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.875 2.383 . . . . 2.04 111.737 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -64.1 -13.0 35.15 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.873 2.382 . . . . 1.52 112.432 -179.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.58 -23.93 53.49 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.031 -0.531 . . . . 2.95 110.098 179.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.457 ' HA ' ' HB3' ' A' ' 72' ' ' ARG . 83.4 mt-30 -100.16 -15.93 17.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.85 -0.614 . . . . 2.56 110.555 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.566 ' HB2' ' HE3' ' A' ' 27' ' ' LYS . 79.8 mt-30 -75.84 125.05 28.35 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.96 -0.564 . . . . 1.4 111.197 -179.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 57.2 mtt180 -128.62 103.46 7.11 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.205 -0.452 . . . . 2.65 109.921 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.455 ' HB3' HD12 ' A' ' 50' ' ' LEU . 80.8 mt -90.06 132.11 35.57 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.343 0.498 . . . . 1.02 112.343 -178.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.501 HG12 ' CE1' ' B' ' 427' ' ' PHE . 1.1 mt -120.93 141.83 39.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.646 -0.706 . . . . 2.14 109.418 179.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.542 ' HB2' HD11 ' A' ' 50' ' ' LEU . 50.0 t80 -128.7 102.72 6.7 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.461 -0.336 . . . . 1.71 110.279 179.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 63.23 12.53 6.2 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.825 -0.625 . . . . 2.1 112.629 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 111.15 -6.88 28.9 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.863 -0.684 . . . . 1.84 112.09 -179.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 82.8 mttt -91.42 137.29 32.48 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.297 -0.26 . . . . 3.05 110.297 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -76.26 123.21 25.55 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 123.432 0.457 . . . . 2.3 110.244 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.542 HD11 ' HB2' ' A' ' 45' ' ' PHE . 42.8 mt -92.6 122.87 35.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.229 -0.441 . . . . 1.17 110.864 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -93.11 145.43 24.41 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.025 -0.534 . . . . 2.65 110.205 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -58.07 -42.12 84.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 1.83 112.197 -179.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.86 41.49 2.59 Favored Glycine 0 CA--C 1.519 0.33 0 C-N-CA 121.339 -0.458 . . . . 1.82 114.201 -178.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -134.58 158.78 43.12 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.263 -0.643 . . . . 2.69 109.263 179.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' A' ' 22' ' ' THR . 0.3 OUTLIER -100.7 155.44 17.89 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.912 -0.403 . . . . 1.71 109.912 179.874 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.441 HD12 ' O ' ' A' ' 18' ' ' GLU . 92.2 mt -59.63 -38.32 81.04 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.828 0.346 . . . . 1.49 111.475 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.27 -20.31 65.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.267 -0.424 . . . . 1.94 111.757 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -69.18 -31.91 70.85 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.818 0.342 . . . . 2.03 110.677 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -98.08 9.86 41.83 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.195 -0.457 . . . . 1.76 111.4 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 65.02 29.36 12.22 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.952 -0.567 . . . . 2.96 111.142 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 83.0 mt -77.47 121.09 29.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.988 -0.551 . . . . 1.65 110.249 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -113.24 -164.35 0.91 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.588 -0.733 . . . . 2.66 110.155 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.403 ' HB3' ' HB2' ' A' ' 1' ' ' MET . 56.9 pttt -73.64 147.53 43.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.596 0.236 . . . . 3.22 110.43 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 64.28 28.97 13.87 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.99 0.737 . . . . 3.12 112.99 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 50.4 m -84.38 140.81 31.31 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.577 -0.527 . . . . 1.83 109.577 178.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -94.18 114.29 26.38 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.431 -0.35 . . . . 2.03 111.305 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.0 mp -106.52 141.71 37.36 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.158 -0.682 . . . . 1.41 109.158 178.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.427 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 75.0 m80 -106.74 147.21 29.9 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 111.53 0.196 . . . . 2.76 111.53 -179.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 27.7 tp -120.8 116.33 25.01 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.095 0.474 . . . . 1.54 111.482 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.486 ' CG2' HD11 ' A' ' 44' ' ' ILE . 0.9 OUTLIER -96.29 143.2 12.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.819 -0.628 . . . . 1.79 110.004 179.104 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 12.4 mt -86.49 134.92 33.63 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.172 -0.467 . . . . 2.43 111.314 -179.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.457 ' HB3' ' HA ' ' A' ' 40' ' ' GLN . 0.2 OUTLIER -112.48 129.94 56.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.034 -0.53 . . . . 3.19 110.359 179.303 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.638 HD12 ' HB3' ' B' ' 420' ' ' GLU . 5.9 mt -118.41 155.36 30.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.882 0.372 . . . . 2.99 111.39 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 32.0 mmt180 . . . . . 0 C--N 1.326 -0.431 0 CA-C-N 116.116 -0.493 . . . . 3.67 110.002 178.78 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 . . . . . 0 N--CA 1.455 -0.212 0 N-CA-C 109.733 -0.469 . . . . 2.51 109.733 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -67.52 130.04 21.39 Favored 'Trans proline' 0 C--O 1.235 0.366 0 C-N-CA 122.55 2.167 . . . . 3.77 111.124 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -54.1 -39.23 66.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.164 -0.471 . . . . 5.36 111.038 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 393' ' ' GLN . . . . . 0.418 ' O ' ' HG2' ' B' ' 397' ' ' GLN . 8.6 tt0 -59.38 -51.11 71.33 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.778 -0.647 . . . . 6.89 110.301 179.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 26.1 m -59.24 -45.25 91.67 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.907 -0.588 . . . . 4.2 111.091 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 395' ' ' ILE . . . . . 0.482 ' O ' ' HG2' ' B' ' 399' ' ' MET . 78.3 mt -58.09 -49.02 82.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 3.8 110.561 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 85.8 mttt -60.0 -42.26 93.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 6.27 112.001 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 397' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' B' ' 393' ' ' GLN . 21.6 mm-40 -62.87 -41.24 99.31 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.887 0.375 . . . . 6.91 110.981 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 80.8 mt -72.79 -26.49 61.54 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.083 -0.508 . . . . 4.31 111.464 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 399' ' ' MET . . . . . 0.482 ' HG2' ' O ' ' B' ' 395' ' ' ILE . 30.7 mmt -62.35 -40.25 95.77 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.315 -0.402 . . . . 5.8 111.293 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -70.45 -17.79 62.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.865 -0.607 . . . . 7.71 112.138 -178.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 401' ' ' LEU . . . . . 0.491 HD22 HD12 ' A' ' 44' ' ' ILE . 94.5 mt -69.51 -16.26 63.41 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.837 0.351 . . . . 5.69 111.75 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 96.87 32.57 6.45 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.711 -0.757 . . . . 5.87 112.178 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -126.4 144.58 49.86 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 110.486 -0.191 . . . . 4.83 110.486 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -72.77 162.78 40.26 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.697 2.265 . . . . 4.72 111.999 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' B' ' 405' ' ' ARG . 14.2 ttt180 -63.51 -28.3 69.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.835 -0.62 . . . . 4.16 111.033 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -56.21 -48.88 75.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.862 -0.608 . . . . 4.69 111.209 179.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -64.94 -35.74 82.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.824 -0.625 . . . . 2.99 110.644 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 73.9 t -63.22 -50.54 78.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.823 -0.626 . . . . 2.06 110.796 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 59.8 t -60.2 -44.31 95.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.502 -0.317 . . . . 2.89 111.403 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -64.15 -50.4 68.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.296 -0.411 . . . . 5.05 111.72 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -63.54 -50.04 71.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 2.96 111.703 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -59.59 -30.45 68.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.332 -0.395 . . . . 3.45 111.969 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 23.5 mmtt -67.35 -48.3 67.88 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.418 -0.355 . . . . 5.52 111.128 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 23.8 pt20 -76.09 -30.96 58.48 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 113.147 0.795 . . . . 5.53 113.147 -179.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 415' ' ' THR . . . . . 0.512 ' HB ' ' ND2' ' B' ' 418' ' ' ASN . 65.4 p -84.02 -8.14 59.21 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.007 0.432 . . . . 5.42 110.915 179.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 61.96 61.1 1.42 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.366 -0.834 . . . . 6.37 112.811 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 74.27 -23.15 1.2 Allowed Glycine 0 CA--C 1.521 0.41 0 CA-C-N 115.493 -0.776 . . . . 4.33 114.928 178.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 418' ' ' ASN . . . . . 0.799 HD21 ' HB2' ' B' ' 421' ' ' PHE . 0.0 OUTLIER -68.91 113.43 6.32 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 117.868 0.834 . . . . 6.25 111.807 -179.291 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 419' ' ' ALA . . . . . 0.458 ' HA ' ' HB3' ' B' ' 422' ' ' ALA . . . -73.29 -20.61 60.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.942 -1.026 . . . . 4.12 112.274 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 420' ' ' GLU . . . . . 0.638 ' HB3' HD12 ' A' ' 73' ' ' LEU . 53.2 mm-40 -61.93 -55.63 27.53 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.36 0.6 . . . . 6.99 110.041 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 421' ' ' PHE . . . . . 0.799 ' HB2' HD21 ' B' ' 418' ' ' ASN . 11.2 m-85 -75.13 -24.56 58.01 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.679 -0.692 . . . . 7.48 110.4 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 422' ' ' ALA . . . . . 0.462 ' O ' ' HG ' ' B' ' 426' ' ' LEU . . . -61.61 -46.69 88.74 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.003 -0.739 . . . . 3.68 109.003 178.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . 0.485 ' HB1' HG13 ' A' ' 70' ' ' VAL . . . -64.47 -38.84 92.43 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.85 -0.613 . . . . 3.8 109.693 179.03 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 49.1 m -66.98 -31.3 71.77 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.049 -0.523 . . . . 5.05 110.781 178.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 425' ' ' LEU . . . . . 0.548 ' O ' ' HG2' ' B' ' 428' ' ' GLN . 0.4 OUTLIER -81.65 -49.41 10.52 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.773 0.657 . . . . 4.36 112.773 -179.507 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 426' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' B' ' 422' ' ' ALA . 4.2 pp -64.88 -33.82 76.92 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 114.599 1.333 . . . . 3.21 114.599 -177.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 427' ' ' PHE . . . . . 0.501 ' CE1' HG12 ' A' ' 44' ' ' ILE . 62.5 t80 -76.34 0.74 18.36 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 113.174 0.805 . . . . 5.27 113.174 -178.322 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 428' ' ' GLN . . . . . 0.548 ' HG2' ' O ' ' B' ' 425' ' ' LEU . 2.1 pt20 -50.93 -46.05 60.73 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.956 0.724 . . . . 5.32 112.956 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 9.5 m . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.549 -0.739 . . . . 5.11 110.361 -179.951 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 ptt? . . . . . 0 N--CA 1.481 1.09 0 CA-C-O 120.623 0.249 . . . . 1.65 110.365 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -105.93 135.18 47.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.864 0.364 . . . . 1.92 111.753 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.1 pt -129.75 165.22 30.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 109.316 -0.624 . . . . 1.48 109.316 178.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.454 ' O ' ' HA ' ' A' ' 66' ' ' THR . 87.6 m-85 -122.54 127.5 49.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.646 0.26 . . . . 2.17 110.622 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.472 ' HB ' ' HB ' ' A' ' 13' ' ' ILE . 44.3 t -110.17 124.84 67.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 116.504 -0.317 . . . . 1.65 110.331 179.593 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.402 ' HE3' HG21 ' A' ' 66' ' ' THR . 75.0 mttt -91.71 149.63 21.52 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.417 -0.356 . . . . 3.16 110.625 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.3 p -126.1 167.84 14.82 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.988 -0.551 . . . . 2.17 109.605 179.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 33.0 mt -65.22 -23.3 67.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.067 0.461 . . . . 3.05 110.454 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.4 -5.53 56.63 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.572 -0.74 . . . . 2.7 111.124 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.18 30.12 57.59 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 121.051 -0.595 . . . . 2.64 112.523 179.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -104.42 129.77 52.36 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 122.774 -0.251 . . . . 2.34 110.574 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.2 m -87.85 112.01 22.02 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.316 -0.402 . . . . 2.31 110.388 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.472 ' HB ' ' HB ' ' A' ' 5' ' ' VAL . 49.0 mt -96.59 116.07 37.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.402 -0.363 . . . . 1.83 110.6 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.58 126.93 32.85 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.717 -0.845 . . . . 2.02 108.717 178.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.511 HD11 HG12 ' A' ' 30' ' ' ILE . 11.5 mt -126.96 139.2 53.21 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.988 0.736 . . . . 1.33 112.988 -178.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -95.13 106.74 18.77 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 114.855 -1.066 . . . . 2.4 108.716 178.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 6.4 m -140.61 171.05 13.59 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-O 120.87 0.366 . . . . 1.25 110.777 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -124.34 153.35 68.9 Favored Pre-proline 0 C--N 1.319 -0.721 0 N-CA-C 108.903 -0.777 . . . . 1.85 108.903 178.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_exo -53.49 -35.87 77.77 Favored 'Trans proline' 0 CA--C 1.53 0.305 0 C-N-CA 122.45 2.1 . . . . 1.78 112.177 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.1 m -85.02 14.56 4.82 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.54 0.571 . . . . 1.8 112.54 -179.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -92.61 135.69 33.86 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.213 -0.662 . . . . 1.23 109.213 178.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.45 147.79 37.68 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.269 -0.423 . . . . 1.44 111.272 -178.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.565 ' HB ' ' HA ' ' A' ' 52' ' ' ASP . 47.3 mm -56.35 -37.41 50.62 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 CA-C-N 116.48 -0.327 . . . . 0.99 110.661 179.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.493 ' HB2' ' HB3' ' A' ' 52' ' ' ASP . 28.4 tt0 -57.76 -40.5 79.92 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.244 -0.435 . . . . 2.22 110.673 179.257 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -69.34 -35.13 75.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.023 -0.535 . . . . 1.23 109.839 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.459 ' O ' HG13 ' A' ' 30' ' ' ILE . 59.7 t -65.54 -41.72 91.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 109.133 -0.692 . . . . 0.64 109.133 178.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.545 ' HE3' ' HB2' ' A' ' 41' ' ' GLN . 2.4 mmmm -60.98 -40.37 93.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.737 -0.665 . . . . 1.32 109.713 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.47 -36.26 82.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.82 -0.627 . . . . 1.08 110.173 179.127 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -65.74 -35.82 81.82 Favored 'General case' 0 C--N 1.334 -0.082 0 CA-C-N 116.132 -0.485 . . . . 1.08 110.112 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.511 HG12 HD11 ' A' ' 15' ' ' LEU . 79.5 mt -69.79 -38.31 75.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 108.801 -0.814 . . . . 1.31 108.801 178.264 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -63.95 -30.4 71.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.529 -0.759 . . . . 1.93 110.473 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -70.41 -17.25 63.01 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.005 -0.543 . . . . 2.05 110.824 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -107.6 -54.34 2.5 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.105 -0.498 . . . . 2.17 112.014 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -79.12 -36.19 41.02 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 111.916 0.339 . . . . 2.14 111.916 -178.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 94.87 -15.65 62.95 Favored Glycine 0 C--O 1.229 -0.189 0 C-N-CA 120.836 -0.697 . . . . 2.01 112.03 -179.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ILE . . . . . 0.402 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 54.2 mt -69.56 126.61 92.7 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 115.905 -0.148 . . . . 1.83 110.746 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.425 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 45.5 Cg_exo -58.68 145.87 94.07 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.124 2.549 . . . . 2.04 112.235 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 37' ' ' PRO . 37.1 Cg_exo -60.05 -21.51 65.6 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.263 2.642 . . . . 1.52 112.638 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.55 -19.76 65.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.265 -0.425 . . . . 2.95 111.735 -179.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -114.01 9.06 17.29 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.086 0.469 . . . . 2.56 110.249 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.545 ' HB2' ' HE3' ' A' ' 27' ' ' LYS . 67.5 mt-30 -98.85 108.84 21.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.622 -0.717 . . . . 1.4 110.925 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.557 ' HB3' ' CD2' ' B' ' 427' ' ' PHE . 11.1 mmt85 -104.8 104.43 14.21 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.019 0.438 . . . . 2.65 109.866 178.524 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.637 ' HB3' HD12 ' A' ' 50' ' ' LEU . 9.9 mt -102.15 134.65 45.06 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.741 -0.663 . . . . 1.02 111.699 -178.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.801 HG22 ' HA ' ' A' ' 49' ' ' GLN . 10.8 pt -138.73 160.97 30.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.989 -0.55 . . . . 2.14 110.185 178.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.495 ' HB2' HD21 ' A' ' 50' ' ' LEU . 53.6 t80 -134.91 106.24 6.77 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.423 -0.584 . . . . 1.71 109.423 179.051 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.92 33.42 19.87 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.086 -0.506 . . . . 2.1 111.725 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 99.95 -31.48 8.38 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.888 -0.673 . . . . 1.84 113.408 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -78.42 130.27 35.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.849 0.324 . . . . 3.05 111.404 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.801 ' HA ' HG22 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -67.77 140.94 56.68 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.914 -0.585 . . . . 2.3 110.529 179.851 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.637 HD12 ' HB3' ' A' ' 43' ' ' LEU . 72.0 mt -97.58 113.01 24.65 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.57 -0.286 . . . . 1.17 110.798 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.621 ' HB2' ' HG2' ' A' ' 54' ' ' ARG . 17.7 mt-10 -76.87 133.06 39.41 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.282 -0.417 . . . . 2.65 109.978 179.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.565 ' HA ' ' HB ' ' A' ' 23' ' ' ILE . 4.1 m-20 -58.94 -29.13 66.9 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.919 -0.582 . . . . 1.83 112.209 -179.198 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.53 2.16 83.36 Favored Glycine 0 CA--C 1.52 0.354 0 C-N-CA 121.055 -0.593 . . . . 1.82 113.719 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.621 ' HG2' ' HB2' ' A' ' 51' ' ' GLU . 15.7 mmt180 -107.99 166.12 10.96 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.073 0.437 . . . . 2.69 110.328 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 76.9 p -105.04 177.39 4.86 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.782 -0.451 . . . . 1.71 109.782 179.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.458 ' HB3' ' HB ' ' A' ' 61' ' ' ILE . 94.8 mt -67.19 -34.87 78.42 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.971 0.415 . . . . 1.49 109.882 179.071 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -27.47 68.93 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.958 -0.565 . . . . 1.94 111.368 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -65.23 -23.34 67.04 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.908 0.385 . . . . 2.03 111.704 -179.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -115.03 16.07 17.13 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.386 -0.37 . . . . 1.76 110.929 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 59.66 29.09 18.64 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.769 -0.651 . . . . 2.96 111.658 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.458 ' HB ' ' HB3' ' A' ' 56' ' ' LEU . 76.7 mt -77.48 119.61 26.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.044 -0.526 . . . . 1.65 110.335 -179.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 15.0 mt-30 -110.96 -167.99 1.25 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.67 -0.695 . . . . 2.66 109.496 -179.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 24.0 pttt -73.3 152.73 40.84 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 121.01 -0.276 . . . . 3.22 110.412 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 70.4 -1.53 2.48 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.574 0.583 . . . . 3.12 112.574 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 69.1 m -69.88 137.19 51.45 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 110.235 -0.283 . . . . 1.83 110.235 179.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.454 ' HA ' ' O ' ' A' ' 4' ' ' PHE . 3.4 m -96.57 120.41 36.84 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.168 0.509 . . . . 2.03 111.713 -179.202 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.7 mp -98.73 156.43 16.84 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.551 -0.907 . . . . 1.41 108.551 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.435 ' HB2' HG13 ' A' ' 44' ' ' ILE . 72.7 m80 -117.03 125.44 51.35 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.862 0.363 . . . . 2.76 111.937 -179.124 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.473 HD13 ' HG ' ' A' ' 43' ' ' LEU . 47.5 tp -115.58 120.36 39.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.921 -0.582 . . . . 1.54 110.521 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.2 t -112.74 138.89 40.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.005 -0.543 . . . . 1.79 110.678 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.8 mt -72.05 122.82 21.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.84 -0.618 . . . . 2.43 110.343 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 59.3 ttt180 -89.92 104.5 17.06 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.29 -0.414 . . . . 3.19 110.553 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.4 mp -69.29 113.35 6.55 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.909 -0.587 . . . . 2.99 110.546 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.4 ' HD2' HH11 ' A' ' 74' ' ' ARG . 8.6 mmt85 . . . . . 0 C--N 1.325 -0.493 0 CA-C-N 116.05 -0.523 . . . . 3.67 110.317 179.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 390' ' ' PHE . . . . . 0.613 ' HB2' HD11 ' B' ' 395' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.257 0 CA-C-O 120.605 0.24 . . . . 2.51 110.423 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 391' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' B' ' 390' ' ' PHE . 10.5 Cg_exo -71.42 136.27 28.33 Favored 'Trans proline' 0 C--O 1.237 0.434 0 C-N-CA 122.792 2.328 . . . . 3.77 111.44 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.75 -36.14 69.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.231 -0.441 . . . . 5.36 112.066 -179.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 393' ' ' GLN . . . . . 0.403 HE21 ' HB3' ' B' ' 393' ' ' GLN . 4.2 tt0 -56.79 -52.89 63.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.045 0.45 . . . . 6.89 110.9 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -67.47 -36.24 80.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.886 -0.597 . . . . 4.2 110.948 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 395' ' ' ILE . . . . . 0.613 ' O ' ' HG2' ' B' ' 399' ' ' MET . 74.1 mt -59.59 -52.28 62.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.058 -0.519 . . . . 3.8 110.224 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 31.8 mttp -56.29 -42.7 77.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.355 -0.384 . . . . 6.27 111.445 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -61.95 -39.01 90.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.276 -0.42 . . . . 6.91 111.23 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 398' ' ' LEU . . . . . 0.413 HD12 HG23 ' B' ' 408' ' ' VAL . 90.4 mt -76.71 -31.67 57.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.401 -0.363 . . . . 4.31 111.316 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 399' ' ' MET . . . . . 0.613 ' HG2' ' O ' ' B' ' 395' ' ' ILE . 35.0 mmt -66.97 -39.96 87.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.075 0.464 . . . . 5.8 110.0 179.388 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -62.38 -28.26 69.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.572 -0.74 . . . . 7.71 111.975 -179.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 401' ' ' LEU . . . . . 0.769 ' HB3' HD11 ' A' ' 44' ' ' ILE . 38.2 mt -63.69 -26.83 68.84 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.071 0.462 . . . . 5.69 110.59 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 111.61 27.1 4.23 Favored Glycine 0 N--CA 1.446 -0.638 0 N-CA-C 111.483 -0.647 . . . . 5.87 111.483 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 403' ' ' PHE . . . . . 0.569 ' HE2' HD13 ' A' ' 44' ' ' ILE . 33.4 m-85 -113.08 143.21 28.72 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-O 120.652 0.263 . . . . 4.83 110.91 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.88 164.62 31.45 Favored 'Trans proline' 0 C--O 1.236 0.418 0 C-N-CA 123.022 2.481 . . . . 4.72 112.949 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 405' ' ' ARG . . . . . 0.501 ' HA ' HG12 ' B' ' 408' ' ' VAL . 91.0 mtt180 -64.12 -28.26 69.65 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.796 -0.638 . . . . 4.16 111.408 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -63.32 -37.71 88.33 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.011 0.434 . . . . 4.69 110.448 179.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -68.56 -45.19 72.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.8 -0.637 . . . . 2.99 111.453 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 408' ' ' VAL . . . . . 0.501 HG12 ' HA ' ' B' ' 405' ' ' ARG . 14.6 p -63.22 -41.23 92.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 N-CA-C 112.091 0.404 . . . . 2.06 112.091 -179.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 74.7 t -64.23 -50.23 77.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.902 0.382 . . . . 2.89 111.143 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -62.85 -40.52 97.69 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.295 -0.411 . . . . 5.05 111.706 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -67.89 -45.43 74.47 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.296 -0.411 . . . . 2.96 110.979 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 412' ' ' LEU . . . . . 0.449 HD13 ' HA2' ' B' ' 417' ' ' GLY . 0.8 OUTLIER -61.26 -33.72 74.0 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.198 -0.456 . . . . 3.45 111.543 -179.671 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 42.3 mmtt -69.76 -50.81 39.67 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.121 0.415 . . . . 5.52 112.121 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -70.29 -23.83 62.93 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 113.17 0.804 . . . . 5.53 113.17 -178.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 415' ' ' THR . . . . . 0.475 HG21 ' HA ' ' B' ' 422' ' ' ALA . 68.6 p -99.01 -5.02 31.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.005 0.431 . . . . 5.42 110.973 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 57.76 61.72 2.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.494 -0.775 . . . . 6.37 112.96 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 417' ' ' GLY . . . . . 0.449 ' HA2' HD13 ' B' ' 412' ' ' LEU . . . 76.92 -14.46 7.46 Favored Glycine 0 CA--C 1.519 0.314 0 N-CA-C 114.902 0.721 . . . . 4.33 114.902 177.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -71.32 94.16 1.19 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 117.733 0.767 . . . . 6.25 110.166 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -61.79 -33.34 73.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.089 -0.505 . . . . 4.12 111.853 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -65.91 -43.43 88.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.238 0.542 . . . . 6.99 109.628 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -73.53 -36.99 65.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.701 -0.681 . . . . 7.48 109.6 179.211 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 422' ' ' ALA . . . . . 0.475 ' HA ' HG21 ' B' ' 415' ' ' THR . . . -59.28 -47.02 86.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.834 -0.621 . . . . 3.68 110.529 179.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -60.23 -46.31 90.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.154 -0.475 . . . . 3.8 110.436 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 61.3 m -65.38 -29.18 69.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.201 -0.454 . . . . 5.05 111.519 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -80.69 -49.71 10.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.416 -0.356 . . . . 4.36 111.947 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 4.2 pp -64.09 -33.03 74.84 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.927 0.343 . . . . 3.21 111.927 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 427' ' ' PHE . . . . . 0.557 ' CD2' ' HB3' ' A' ' 42' ' ' ARG . 2.0 m-85 -63.07 -11.03 16.79 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.772 0.656 . . . . 5.27 112.772 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -67.05 -20.55 65.86 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.764 0.316 . . . . 5.32 110.943 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 1.6 m . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.775 -0.631 . . . . 5.11 110.741 179.984 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.483 ' HB2' ' HB3' ' A' ' 63' ' ' LYS . 22.7 ptt? . . . . . 0 N--CA 1.484 1.251 0 N-CA-C 110.463 -0.199 . . . . 1.65 110.463 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 55.0 mm-40 -109.4 143.06 39.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.468 0.175 . . . . 1.92 110.764 -179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 25.0 pt -128.7 162.83 34.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.473 -0.331 . . . . 1.48 110.535 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -118.34 112.23 19.77 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.429 -0.35 . . . . 2.17 110.921 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.82 ' HB ' ' HB ' ' A' ' 13' ' ' ILE . 25.1 t -98.86 114.58 37.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.298 -0.41 . . . . 1.65 110.602 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 80.6 mttt -86.91 125.91 34.34 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.29 -0.414 . . . . 3.16 111.132 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.17 162.15 13.49 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.045 -0.525 . . . . 2.17 109.797 179.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 85.5 mt -64.56 -11.03 30.3 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 112.235 0.457 . . . . 3.05 112.235 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.25 11.94 34.68 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.217 -0.447 . . . . 2.7 111.077 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 71.16 28.27 70.47 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 121.195 -0.526 . . . . 2.64 112.641 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -101.26 143.84 30.84 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 110.511 -0.181 . . . . 2.34 110.511 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.6 m -107.46 105.04 14.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.055 0.455 . . . . 2.31 110.858 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.82 ' HB ' ' HB ' ' A' ' 5' ' ' VAL . 70.9 mt -86.1 114.44 25.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.86 -0.609 . . . . 1.83 109.891 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.7 m -96.33 113.69 25.3 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.739 -0.467 . . . . 2.02 109.739 179.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.445 ' HG ' HG22 ' A' ' 13' ' ' ILE . 56.6 mt -122.64 156.63 33.92 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.97 0.414 . . . . 1.33 111.732 -179.195 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -101.01 119.36 38.63 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.458 -0.792 . . . . 2.4 109.685 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.418 ' O ' ' HG2' ' A' ' 1' ' ' MET . 13.2 m -142.22 -171.86 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 116.101 -0.5 . . . . 1.25 110.042 -179.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.407 ' O ' HD12 ' A' ' 56' ' ' LEU . 25.5 mm-40 -152.55 156.32 33.26 Favored Pre-proline 0 C--N 1.322 -0.604 0 N-CA-C 107.903 -1.147 . . . . 1.85 107.903 179.002 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.47 ' HA ' ' HB2' ' A' ' 56' ' ' LEU . 73.4 Cg_exo -51.89 -35.16 58.79 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 122.422 2.081 . . . . 1.78 112.003 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.8 m -75.06 8.33 2.65 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 112.931 0.715 . . . . 1.8 112.931 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -92.41 147.96 22.49 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 122.187 -0.321 . . . . 1.23 110.451 179.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.8 OUTLIER -93.96 152.04 19.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.317 -0.401 . . . . 1.44 110.652 -179.515 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.433 ' HB ' ' HA ' ' A' ' 52' ' ' ASP . 49.8 mm -58.05 -43.17 84.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.398 -0.364 . . . . 0.99 110.411 179.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.619 ' HG3' ' HB3' ' A' ' 52' ' ' ASP . 37.7 mt-10 -57.88 -37.59 74.24 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.107 -0.497 . . . . 2.22 110.861 179.051 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.485 ' O ' ' HG3' ' A' ' 29' ' ' LYS . 56.2 t30 -72.67 -37.26 67.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.34 -0.391 . . . . 1.23 110.594 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 92.7 t -63.51 -46.95 93.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.199 -0.455 . . . . 0.64 110.016 179.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 19.4 mtmt -64.51 -31.87 73.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.11 -0.496 . . . . 1.32 110.72 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.62 -36.61 83.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.165 -0.47 . . . . 1.08 110.082 179.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 69.1 mttt -68.7 -40.34 80.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.986 -0.552 . . . . 1.08 109.744 179.216 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 50.3 mt -66.67 -38.96 82.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.991 -0.55 . . . . 1.31 109.586 179.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -61.29 -36.53 80.33 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.396 -0.82 . . . . 1.93 111.922 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -72.2 -38.77 68.98 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 112.811 0.671 . . . . 2.05 112.811 -178.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -87.03 -43.93 11.96 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 113.208 0.818 . . . . 2.17 113.208 -178.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -82.67 -22.2 34.68 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.707 0.632 . . . . 2.14 112.707 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 73.92 26.36 69.22 Favored Glycine 0 CA--C 1.517 0.197 0 C-N-CA 120.694 -0.765 . . . . 2.01 112.279 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 80.2 mt -108.12 128.28 26.03 Favored Pre-proline 0 C--N 1.326 -0.449 0 N-CA-C 110.106 -0.331 . . . . 1.83 110.106 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -55.21 132.78 54.31 Favored 'Trans proline' 0 C--N 1.346 0.429 0 C-N-CA 122.908 2.405 . . . . 2.04 111.999 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -57.91 -22.59 55.14 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 123.031 2.487 . . . . 1.52 112.92 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -69.62 -29.56 67.08 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.766 0.317 . . . . 2.95 111.412 179.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -94.16 -3.79 50.3 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.288 -0.414 . . . . 2.56 110.534 -179.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -86.48 107.89 18.28 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.959 -0.564 . . . . 1.4 111.5 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.461 ' HB3' ' CE2' ' B' ' 427' ' ' PHE . 12.0 mmt85 -109.76 109.01 19.57 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.221 -0.659 . . . . 2.65 109.221 178.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.48 ' HB3' HD12 ' A' ' 50' ' ' LEU . 30.9 mt -87.07 136.61 32.86 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.016 0.436 . . . . 1.02 112.159 -179.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.723 HD11 HG23 ' A' ' 70' ' ' VAL . 1.1 mt -122.41 145.09 29.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.688 -0.687 . . . . 2.14 110.298 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.441 ' CB ' HD21 ' A' ' 50' ' ' LEU . 46.2 t80 -133.92 97.33 3.86 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.952 -0.567 . . . . 1.71 109.507 178.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 61.35 40.98 13.6 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.764 -0.653 . . . . 2.1 111.99 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.12 -5.94 84.17 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 120.949 -0.643 . . . . 1.84 113.775 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.0 mtmt -103.36 136.27 43.42 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.858 0.329 . . . . 3.05 110.545 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.452 ' OE1' ' HD2' ' A' ' 42' ' ' ARG . 5.9 tt0 -78.61 136.42 37.5 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.618 0.247 . . . . 2.3 110.408 179.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.48 HD12 ' HB3' ' A' ' 43' ' ' LEU . 71.4 mt -93.88 137.25 33.31 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.916 0.389 . . . . 1.17 111.383 -179.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.598 ' HB2' ' HG2' ' A' ' 54' ' ' ARG . 3.3 mt-10 -87.9 132.21 34.29 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.116 -0.493 . . . . 2.65 109.731 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.619 ' HB3' ' HG3' ' A' ' 24' ' ' GLU . 4.1 m-20 -59.37 -32.07 69.79 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 112.906 0.706 . . . . 1.83 112.906 -179.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -87.71 33.12 4.03 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.762 -0.732 . . . . 1.82 113.697 -179.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.598 ' HG2' ' HB2' ' A' ' 51' ' ' GLU . 24.4 mmt180 -131.46 171.33 13.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.809 0.337 . . . . 2.69 110.339 179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 22' ' ' THR . 67.6 p -109.09 168.61 9.24 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.285 -0.635 . . . . 1.71 109.285 179.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.47 ' HB2' ' HA ' ' A' ' 19' ' ' PRO . 65.8 mt -66.88 -29.23 69.08 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.98 0.419 . . . . 1.49 110.139 179.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.78 -25.87 65.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.959 -0.564 . . . . 1.94 111.226 179.303 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -62.99 -26.76 69.01 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.39 -0.368 . . . . 2.03 111.658 -179.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.463 ' HB2' HG13 ' A' ' 61' ' ' ILE . 70.7 m-85 -112.7 9.03 19.17 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.26 -0.427 . . . . 1.76 109.999 179.766 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 58.24 39.39 25.77 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.436 -0.802 . . . . 2.96 111.314 -179.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.463 HG13 ' HB2' ' A' ' 59' ' ' TYR . 78.0 mt -76.0 109.94 10.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.807 -0.633 . . . . 1.65 110.046 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -99.0 -172.42 2.28 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.85 -0.614 . . . . 2.66 111.186 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.483 ' HB3' ' HB2' ' A' ' 1' ' ' MET . 52.8 pttt -68.6 151.01 47.32 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.246 -0.434 . . . . 3.22 112.077 -179.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 65.54 22.08 11.78 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.367 -0.833 . . . . 3.12 112.98 178.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.3 m -87.83 145.7 25.95 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.741 0.305 . . . . 1.83 110.299 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 4.2 m -95.36 128.51 42.27 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.145 -0.479 . . . . 2.03 111.597 -179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.425 ' O ' ' HA ' ' A' ' 5' ' ' VAL . 6.8 mp -119.48 143.59 47.45 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.422 -0.955 . . . . 1.41 108.422 178.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.614 ' HB2' ' HB ' ' A' ' 44' ' ' ILE . 46.9 m80 -105.33 149.22 26.25 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 120.534 0.207 . . . . 2.76 110.729 -179.089 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 54.8 tp -126.76 111.09 13.83 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.064 0.459 . . . . 1.54 111.512 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.723 HG23 HD11 ' A' ' 44' ' ' ILE . 4.5 t -101.09 129.4 52.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.978 -0.555 . . . . 1.79 110.076 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 69.8 mt -86.18 97.14 10.18 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.063 -0.517 . . . . 2.43 109.649 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.41 ' HA ' ' OG ' ' B' ' 424' ' ' SER . 55.3 ttt-85 -89.62 106.28 18.35 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.098 0.475 . . . . 3.19 111.17 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 57.1 mt -84.75 -169.22 2.53 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.738 -0.664 . . . . 2.99 110.207 179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 74' ' ' ARG . 17.1 mmt180 -120.33 102.35 8.42 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 110.012 -0.366 . . . . 3.67 110.012 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 132.83 -149.78 19.62 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.788 -0.72 . . . . 3.08 112.291 179.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.086 0 CA-C-O 118.941 -0.921 . . . . 3.82 111.602 -179.813 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.567 0 N-CA-C 111.859 -0.496 . . . . 5.66 111.859 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 1.6 m -83.59 53.94 2.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.185 0.517 . . . . 5.53 110.885 -179.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -87.27 76.1 9.21 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.079 -0.51 . . . . 3.98 110.764 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.97 -13.99 60.58 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.001 -0.545 . . . . 4.15 111.12 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 390' ' ' PHE . . . . . 0.508 ' HB2' HD11 ' B' ' 395' ' ' ILE . 2.1 m-85 -106.61 107.37 60.05 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 2.51 110.095 -179.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 391' ' ' PRO . . . . . 0.464 ' O ' HG13 ' B' ' 395' ' ' ILE . 21.2 Cg_exo -66.14 125.74 14.6 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.894 2.396 . . . . 3.77 111.419 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 392' ' ' GLU . . . . . 0.514 ' HG2' ' HE3' ' B' ' 396' ' ' LYS . 40.5 tt0 -52.68 -49.39 65.37 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 112.499 0.555 . . . . 5.36 112.499 -178.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 393' ' ' GLN . . . . . 0.489 HE21 ' HB3' ' B' ' 393' ' ' GLN . 0.5 OUTLIER -53.55 -52.87 58.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 6.89 111.655 -179.831 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . 0.405 ' OG1' ' HB2' ' B' ' 391' ' ' PRO . 0.3 OUTLIER -66.08 -36.55 83.48 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.622 0.601 . . . . 4.2 112.622 -178.652 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 395' ' ' ILE . . . . . 0.508 HD11 ' HB2' ' B' ' 390' ' ' PHE . 89.1 mt -58.3 -48.84 83.83 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 N-CA-C 109.585 -0.524 . . . . 3.8 109.585 178.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 396' ' ' LYS . . . . . 0.514 ' HE3' ' HG2' ' B' ' 392' ' ' GLU . 95.3 mttt -62.98 -40.14 96.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.603 -0.726 . . . . 6.27 110.641 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 397' ' ' GLN . . . . . 0.492 ' O ' ' HG ' ' B' ' 401' ' ' LEU . 12.3 mm-40 -62.5 -47.7 82.82 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.16 -0.473 . . . . 6.91 110.983 179.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 398' ' ' LEU . . . . . 0.464 HD11 ' HB1' ' B' ' 419' ' ' ALA . 95.4 mt -64.8 -41.97 95.4 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.354 -0.384 . . . . 4.31 111.548 -179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 57.7 mtp -69.55 -31.6 69.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.895 0.379 . . . . 5.8 111.406 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -66.01 -18.84 65.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.943 -0.571 . . . . 7.71 111.381 -179.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 401' ' ' LEU . . . . . 0.601 ' HA ' ' CD2' ' A' ' 68' ' ' HIS . 16.8 mt -78.51 2.28 19.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.971 -0.559 . . . . 5.69 110.933 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 93.2 41.12 4.65 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.927 -0.654 . . . . 5.87 111.844 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 403' ' ' PHE . . . . . 0.462 ' HE2' HD13 ' A' ' 44' ' ' ILE . 74.4 m-85 -132.1 146.18 60.57 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 120.524 0.202 . . . . 4.83 110.462 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -79.43 164.2 24.04 Favored 'Trans proline' 0 C--O 1.234 0.276 0 C-N-CA 122.479 2.119 . . . . 4.72 111.638 179.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' B' ' 405' ' ' ARG . 14.5 ttt85 -64.91 -29.21 70.14 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.337 -0.392 . . . . 4.16 110.809 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -58.51 -44.12 89.38 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.819 -0.628 . . . . 4.69 110.978 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -66.34 -38.48 87.74 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.656 -0.702 . . . . 2.99 110.476 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 67.9 t -64.01 -50.98 74.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.636 -0.711 . . . . 2.06 110.985 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 86.2 t -56.99 -51.1 73.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 112.219 0.451 . . . . 2.89 112.219 -179.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 78.9 mttt -64.68 -44.68 89.57 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 112.254 0.465 . . . . 5.05 112.254 -179.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -65.09 -38.43 90.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.841 0.353 . . . . 2.96 110.587 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.71 -35.99 73.01 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.059 -0.519 . . . . 3.45 110.476 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? -60.23 -38.16 82.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.062 -0.517 . . . . 5.52 111.674 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 22.8 pt20 -87.4 -7.43 57.72 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.962 0.727 . . . . 5.53 112.962 -179.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 415' ' ' THR . . . . . 0.494 ' HB ' ' ND2' ' B' ' 418' ' ' ASN . 16.2 p -108.46 -30.56 8.22 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.214 0.45 . . . . 5.42 112.214 -179.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 70.09 63.56 0.23 Allowed 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 114.123 1.157 . . . . 6.37 114.123 179.025 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 89.67 -26.78 8.79 Favored Glycine 0 C--N 1.32 -0.313 0 N-CA-C 115.569 0.988 . . . . 4.33 115.569 176.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 418' ' ' ASN . . . . . 0.623 HD22 ' HB2' ' B' ' 421' ' ' PHE . 0.3 OUTLIER -80.05 80.3 6.48 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 118.197 0.998 . . . . 6.25 110.361 179.476 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 419' ' ' ALA . . . . . 0.464 ' HB1' HD11 ' B' ' 398' ' ' LEU . . . -59.78 -27.05 66.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.98 -1.009 . . . . 4.12 112.125 -178.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -62.46 -41.73 98.97 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.238 -1.023 . . . . 6.99 108.238 178.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 421' ' ' PHE . . . . . 0.623 ' HB2' HD22 ' B' ' 418' ' ' ASN . 44.7 m-85 -76.98 -30.69 56.07 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.243 -0.89 . . . . 7.48 109.319 178.683 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 422' ' ' ALA . . . . . 0.437 ' HB3' ' HA ' ' B' ' 419' ' ' ALA . . . -62.95 -43.81 97.78 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.935 -0.575 . . . . 3.68 109.715 178.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.464 ' HA ' ' HG ' ' B' ' 426' ' ' LEU . . . -63.89 -39.23 93.7 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.15 -0.685 . . . . 3.8 109.15 178.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 424' ' ' SER . . . . . 0.41 ' OG ' ' HA ' ' A' ' 72' ' ' ARG . 50.9 m -62.95 -30.89 71.92 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.623 -0.717 . . . . 5.05 110.373 178.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 425' ' ' LEU . . . . . 0.65 ' O ' ' HG2' ' B' ' 428' ' ' GLN . 2.8 mm? -81.18 -49.62 10.58 Favored 'General case' 0 C--O 1.224 -0.242 0 CA-C-N 115.808 -0.633 . . . . 4.36 111.77 -179.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 426' ' ' LEU . . . . . 0.464 ' HG ' ' HA ' ' B' ' 423' ' ' ALA . 4.4 pp -64.22 -33.72 76.44 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.728 0.64 . . . . 3.21 112.728 -179.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 427' ' ' PHE . . . . . 0.598 ' CZ ' HG12 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -75.86 -1.4 25.11 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 113.878 1.066 . . . . 5.27 113.878 -178.697 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 428' ' ' GLN . . . . . 0.65 ' HG2' ' O ' ' B' ' 425' ' ' LEU . 3.7 pt20 -89.7 11.31 20.27 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.105 0.479 . . . . 5.32 111.258 179.325 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 C--O 1.248 1.025 0 CA-C-N 116.054 -0.521 . . . . 5.11 110.61 179.546 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.587 ' HB2' ' HB3' ' A' ' 63' ' ' LYS . 25.9 ptt? . . . . . 0 N--CA 1.481 1.076 0 CA-C-O 120.618 0.246 . . . . 1.65 110.664 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 75.3 mm-40 -99.28 134.4 42.19 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.763 0.316 . . . . 1.92 110.908 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 23.3 pt -127.53 155.8 38.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.315 -0.402 . . . . 1.48 110.087 178.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -116.9 124.56 49.75 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.404 -0.362 . . . . 2.17 110.454 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.3 t -111.21 123.49 67.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 N-CA-C 110.108 -0.33 . . . . 1.65 110.108 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -104.31 139.95 38.56 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.446 -0.343 . . . . 3.16 110.922 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.478 ' OG1' ' HB3' ' A' ' 11' ' ' LYS . 6.4 p -107.26 174.21 5.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.345 -0.388 . . . . 2.17 110.79 179.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.585 HD11 ' HB1' ' B' ' 423' ' ' ALA . 1.2 mt -58.81 -33.55 70.49 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.86 -0.609 . . . . 3.05 112.086 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.91 -3.2 47.08 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.039 0.385 . . . . 2.7 112.039 -179.118 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 88.91 8.17 69.75 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.755 -0.736 . . . . 2.64 112.252 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.478 ' HB3' ' OG1' ' A' ' 7' ' ' THR . 77.4 tttt -79.66 121.96 25.94 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.72 -0.474 . . . . 2.34 109.72 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.8 m -103.65 128.12 51.01 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.917 0.389 . . . . 2.31 111.185 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 18.4 mt -115.17 143.41 25.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 N-CA-C 109.685 -0.487 . . . . 1.83 109.685 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.5 m -111.96 125.6 54.24 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.652 0.263 . . . . 2.02 110.306 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.8 mp -127.01 142.57 51.52 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.277 -0.419 . . . . 1.33 110.916 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -99.19 106.2 18.33 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 116.078 -0.51 . . . . 2.4 109.967 179.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.427 ' O ' ' HG2' ' A' ' 1' ' ' MET . 7.0 m -134.16 164.08 35.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 109.307 -0.627 . . . . 1.25 109.307 179.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.481 ' HA ' ' OE1' ' A' ' 18' ' ' GLU . 5.9 mm-40 -104.92 155.34 37.72 Favored Pre-proline 0 C--N 1.32 -0.689 0 C-N-CA 121.106 -0.238 . . . . 1.85 110.439 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_exo -58.12 -17.43 31.76 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.991 2.461 . . . . 1.78 113.008 -179.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.1 -1.75 58.24 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.514 -0.312 . . . . 1.8 111.804 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -79.32 142.56 35.98 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.902 0.382 . . . . 1.23 111.032 -179.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.6 m -81.59 146.79 29.93 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.784 -0.644 . . . . 1.44 110.269 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.406 HG12 ' O ' ' A' ' 54' ' ' ARG . 43.0 mm -53.07 -44.97 52.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.283 0 O-C-N 123.202 0.314 . . . . 0.99 111.585 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -58.35 -41.22 84.2 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.481 -0.327 . . . . 2.22 111.527 179.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -63.45 -36.42 83.7 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.992 0.425 . . . . 1.23 110.383 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.402 ' O ' HG13 ' A' ' 30' ' ' ILE . 58.1 t -67.1 -42.61 88.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.989 -0.55 . . . . 0.64 109.572 178.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 27.3 mtmt -63.31 -37.38 87.04 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.207 -0.451 . . . . 1.32 110.37 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.86 -37.38 84.31 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.097 -0.501 . . . . 1.08 109.844 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -68.49 -34.21 75.52 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.793 -0.639 . . . . 1.08 110.143 179.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.402 HG13 ' O ' ' A' ' 26' ' ' VAL . 70.9 mt -70.63 -32.85 50.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 108.97 -0.752 . . . . 1.31 108.97 178.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -66.31 -32.89 74.57 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.484 -0.78 . . . . 1.93 109.383 178.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -71.79 -42.92 66.52 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.456 -0.793 . . . . 2.05 109.705 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -66.82 -59.66 3.35 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.675 -0.693 . . . . 2.17 112.186 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -92.0 -65.27 1.02 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.197 -0.456 . . . . 2.14 112.179 -178.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 133.54 0.72 4.0 Favored Glycine 0 N--CA 1.453 -0.221 0 C-N-CA 120.323 -0.941 . . . . 2.01 112.652 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 16.7 mt -67.83 125.1 90.91 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 110.144 -0.317 . . . . 1.83 110.144 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.423 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 52.4 Cg_exo -54.84 135.89 69.77 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 122.73 2.286 . . . . 2.04 111.423 179.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 37' ' ' PRO . 75.6 Cg_exo -51.54 -30.58 36.29 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 123.271 2.647 . . . . 1.52 113.438 -179.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -70.16 -29.69 66.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.162 0.506 . . . . 2.95 111.584 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -89.0 -4.46 58.42 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.342 -0.39 . . . . 2.56 110.289 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -92.85 111.82 23.56 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.797 -0.638 . . . . 1.4 111.173 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.497 ' HB3' ' CZ ' ' B' ' 427' ' ' PHE . 0.9 OUTLIER -125.07 104.3 8.47 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 108.618 -0.882 . . . . 2.65 108.618 178.713 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.471 ' HB3' HD12 ' A' ' 50' ' ' LEU . 82.8 mt -81.99 138.09 34.98 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.9 0.704 . . . . 1.02 112.9 -178.088 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 65.8 mt -124.09 134.96 65.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.265 -0.88 . . . . 2.14 109.732 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.47 ' HE1' ' HB3' ' A' ' 65' ' ' SER . 57.3 t80 -124.19 107.16 10.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.446 -0.343 . . . . 1.71 110.274 179.239 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.33 35.1 23.13 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.882 -0.599 . . . . 2.1 112.108 179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.562 ' HA2' ' HA3' ' B' ' 402' ' ' GLY . . . 92.71 -13.48 67.38 Favored Glycine 0 CA--C 1.518 0.28 0 C-N-CA 120.909 -0.662 . . . . 1.84 112.924 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.3 mttt -90.44 142.12 28.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.657 0.228 . . . . 3.05 110.807 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.511 HE22 ' HE1' ' B' ' 427' ' ' PHE . 6.3 tp-100 -83.61 135.76 34.49 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 110.025 -0.361 . . . . 2.3 110.025 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.471 HD12 ' HB3' ' A' ' 43' ' ' LEU . 40.7 mt -97.58 135.85 38.83 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.717 0.294 . . . . 1.17 110.943 -179.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.419 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 31.7 tt0 -96.51 138.48 34.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.007 0.432 . . . . 2.65 111.078 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.25 -26.49 66.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.63 -0.713 . . . . 1.83 112.527 -179.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.419 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -87.75 11.21 67.2 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.736 -0.745 . . . . 1.82 114.043 -178.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.427 HH11 ' HD3' ' A' ' 54' ' ' ARG . 41.9 mmt-85 -117.79 164.07 15.56 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 117.26 0.53 . . . . 2.69 111.11 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 61.1 p -102.05 171.83 7.27 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.175 -0.466 . . . . 1.71 110.202 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 84.0 mt -63.95 -33.72 76.36 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.105 0.479 . . . . 1.49 110.528 179.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 67.4 m -70.03 -23.94 63.19 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.921 -0.581 . . . . 1.94 111.332 179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 15.9 m-20 -67.25 -20.21 65.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.397 -0.365 . . . . 2.03 111.758 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -114.66 12.57 17.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.105 -0.498 . . . . 1.76 110.735 179.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.0 m-20 58.49 37.86 25.56 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.667 -0.697 . . . . 2.96 111.625 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 86.9 mt -82.76 120.5 34.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.123 -0.49 . . . . 1.65 110.112 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -106.33 -167.69 1.33 Allowed 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.943 -0.571 . . . . 2.66 109.975 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.587 ' HB3' ' HB2' ' A' ' 1' ' ' MET . 10.0 pttp -76.45 150.79 36.66 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 121.116 -0.233 . . . . 3.22 110.629 179.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 70.99 14.16 6.87 Favored 'General case' 0 C--O 1.235 0.29 0 O-C-N 123.654 0.597 . . . . 3.12 112.155 -179.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.47 ' HB3' ' HE1' ' A' ' 45' ' ' PHE . 35.5 m -79.0 149.66 32.16 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.301 -0.409 . . . . 1.83 109.976 178.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -105.04 124.69 49.97 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.117 -0.492 . . . . 2.03 111.059 -179.24 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 8.0 mp -110.8 138.5 47.12 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.993 -0.743 . . . . 1.41 108.993 179.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 65.3 m80 -103.31 136.96 42.1 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.711 0.291 . . . . 2.76 111.587 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 48.5 tp -123.59 102.3 7.78 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.993 -0.548 . . . . 1.54 109.96 179.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.705 ' HB ' ' CE2' ' B' ' 427' ' ' PHE . 16.5 t -92.21 135.65 26.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.041 -0.527 . . . . 1.79 109.792 179.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.567 ' H ' HD12 ' A' ' 8' ' ' LEU . 65.6 mt -83.22 124.62 30.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.374 -0.375 . . . . 2.43 111.452 -179.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 38.1 ttt180 -118.67 99.11 6.58 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.891 -0.595 . . . . 3.19 110.836 179.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 89.0 mt -72.42 167.44 20.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.025 -0.534 . . . . 2.99 110.457 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.472 ' HD3' ' HA ' ' A' ' 74' ' ' ARG . 0.3 OUTLIER -103.37 -27.38 12.48 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.859 0.361 . . . . 3.67 111.204 -179.692 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -164.36 179.46 39.15 Favored Glycine 0 N--CA 1.446 -0.679 0 N-CA-C 111.307 -0.717 . . . . 3.08 111.307 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.89 0 CA-C-O 118.82 -0.989 . . . . 3.82 111.712 179.892 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.825 0 N-CA-C 111.904 -0.478 . . . . 5.66 111.904 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.55 81.29 7.69 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.06 0.457 . . . . 5.53 110.928 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -121.51 86.95 2.66 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.052 0.453 . . . . 3.98 110.391 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 1.2 m -73.69 -16.19 61.21 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.84 -0.618 . . . . 4.15 110.671 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -111.2 102.04 51.89 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-N 116.059 -0.519 . . . . 2.51 109.931 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo -64.91 132.42 32.3 Favored 'Trans proline' 0 C--O 1.236 0.404 0 C-N-CA 122.667 2.244 . . . . 3.77 111.606 179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -51.77 -45.26 63.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.734 -0.666 . . . . 5.36 112.678 -178.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -54.5 -48.62 71.66 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.235 0.457 . . . . 6.89 112.235 -179.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.54 -39.17 93.27 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.286 -0.416 . . . . 4.2 110.898 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 395' ' ' ILE . . . . . 0.47 ' O ' ' HG2' ' B' ' 399' ' ' MET . 83.0 mt -62.73 -42.0 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.117 0 CA-C-N 116.19 -0.459 . . . . 3.8 110.197 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 84.2 mttt -57.18 -43.71 82.9 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.186 -0.461 . . . . 6.27 111.382 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 8.8 tp60 -65.8 -41.6 91.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.021 0.438 . . . . 6.91 110.808 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 92.8 mt -67.74 -34.94 77.82 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.166 -0.47 . . . . 4.31 111.908 -179.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 399' ' ' MET . . . . . 0.47 ' HG2' ' O ' ' B' ' 395' ' ' ILE . 31.5 mmt -67.27 -33.78 76.04 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.979 0.418 . . . . 5.8 110.172 179.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -61.58 -27.2 68.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.527 -0.76 . . . . 7.71 111.697 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 401' ' ' LEU . . . . . 0.42 HD22 HG22 ' A' ' 70' ' ' VAL . 30.9 mt -74.3 -6.45 48.09 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.12 -0.491 . . . . 5.69 112.155 -179.332 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 402' ' ' GLY . . . . . 0.562 ' HA3' ' HA2' ' A' ' 47' ' ' GLY . . . 85.53 46.36 5.51 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.609 -0.805 . . . . 5.87 112.384 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 403' ' ' PHE . . . . . 0.409 ' HA ' ' HD3' ' B' ' 404' ' ' PRO . 24.6 m-85 -125.64 156.98 70.03 Favored Pre-proline 0 C--N 1.329 -0.285 0 C-N-CA 122.205 0.202 . . . . 4.83 110.577 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 404' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' B' ' 403' ' ' PHE . 2.0 Cg_endo -84.65 146.31 10.63 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.864 2.376 . . . . 4.72 111.084 178.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.411 ' HA ' ' HE1' ' B' ' 399' ' ' MET . 37.4 ttt180 -63.58 -32.24 73.64 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.784 0.29 . . . . 4.16 111.784 -179.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -57.24 -40.07 76.85 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.154 0.502 . . . . 4.69 110.719 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -69.79 -36.69 75.91 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.759 -0.655 . . . . 2.99 109.931 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 49.7 t -63.24 -44.11 99.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.655 -0.702 . . . . 2.06 110.272 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 74.1 t -56.52 -49.09 79.03 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.002 -0.544 . . . . 2.89 109.877 179.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 51.4 mttp -63.82 -47.99 78.61 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.789 -0.641 . . . . 5.05 110.822 179.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 411' ' ' ALA . . . . . 0.607 ' HA ' HE21 ' B' ' 414' ' ' GLN . . . -57.32 -51.04 71.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.807 -0.633 . . . . 2.96 112.563 -178.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 5.2 mp -68.78 -31.33 70.28 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.459 0.541 . . . . 3.45 112.459 -179.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 8.8 mmtt -69.29 -41.56 76.66 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.083 0.401 . . . . 5.52 112.083 -179.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 414' ' ' GLN . . . . . 0.607 HE21 ' HA ' ' B' ' 411' ' ' ALA . 23.9 pt20 -81.15 -8.57 59.79 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.7 0.63 . . . . 5.53 112.7 -179.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 415' ' ' THR . . . . . 0.435 ' HB ' ' HB3' ' B' ' 418' ' ' ASN . 40.9 p -113.3 -4.83 13.63 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.792 0.329 . . . . 5.42 110.961 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 56.3 m-20 63.59 58.25 1.34 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.756 -0.656 . . . . 6.37 111.933 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 69.69 8.25 59.98 Favored Glycine 0 C--O 1.229 -0.178 0 CA-C-N 115.616 -0.72 . . . . 4.33 114.089 178.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 418' ' ' ASN . . . . . 0.435 ' HB3' ' HB ' ' B' ' 415' ' ' THR . 9.3 t-20 -76.99 82.98 3.51 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 122.324 -0.515 . . . . 6.25 109.734 179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -48.16 -47.8 34.77 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 113.61 0.967 . . . . 4.12 113.61 -178.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 4.1 pm0 -65.48 -43.36 90.48 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.813 0.34 . . . . 6.99 111.889 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -69.23 -35.47 76.19 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.148 0.499 . . . . 7.48 110.0 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 422' ' ' ALA . . . . . 0.41 ' HB1' ' HB1' ' B' ' 411' ' ' ALA . . . -65.51 -37.51 87.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.47 -0.786 . . . . 3.68 110.397 179.005 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.585 ' HB1' HD11 ' A' ' 8' ' ' LEU . . . -60.2 -43.36 95.98 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.052 0.454 . . . . 3.8 109.991 179.207 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 65.8 m -74.85 -38.59 61.95 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.958 -0.565 . . . . 5.05 111.514 179.073 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.5 -46.23 80.51 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.584 -0.28 . . . . 4.36 111.529 -179.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.58 -33.22 72.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.351 -0.386 . . . . 3.21 111.249 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 427' ' ' PHE . . . . . 0.705 ' CE2' ' HB ' ' A' ' 70' ' ' VAL . 0.1 OUTLIER -70.93 -0.94 10.34 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.332 0.493 . . . . 5.27 112.332 -179.882 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -70.29 -6.02 31.98 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.089 0.471 . . . . 5.32 110.996 178.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 30.0 m . . . . . 0 C--O 1.246 0.916 0 CA-C-O 118.692 -0.671 . . . . 5.11 109.871 179.036 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 ptt? . . . . . 0 N--CA 1.479 1.003 0 N-CA-C 110.048 -0.352 . . . . 1.65 110.048 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 75.2 mm-40 -103.84 133.47 48.76 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.616 0.246 . . . . 1.92 110.986 -179.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 23.5 pt -129.3 169.34 20.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.31 -0.405 . . . . 1.48 110.04 179.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.443 ' O ' ' HA ' ' A' ' 66' ' ' THR . 62.4 m-85 -125.45 135.15 52.04 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.423 -0.353 . . . . 2.17 110.23 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.42 HG21 HD12 ' A' ' 15' ' ' LEU . 61.8 t -118.18 120.58 64.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.555 -0.293 . . . . 1.65 110.348 179.574 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.429 ' HE2' HG21 ' A' ' 66' ' ' THR . 38.0 mtmt -96.94 128.6 44.06 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.25 0.547 . . . . 3.16 111.48 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.06 160.07 14.55 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.655 -0.702 . . . . 2.17 110.126 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.645 ' HG ' HG22 ' A' ' 70' ' ' VAL . 0.5 OUTLIER -60.16 -28.16 67.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.78 0.324 . . . . 3.05 111.447 179.97 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.26 29.84 0.22 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.384 -0.371 . . . . 2.7 111.742 -179.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 51.66 46.49 53.78 Favored Glycine 0 C--N 1.334 0.441 0 C-N-CA 121.416 -0.421 . . . . 2.64 112.75 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -126.77 153.67 45.26 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 110.128 -0.323 . . . . 2.34 110.128 -179.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.1 m -128.17 121.42 29.44 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.014 0.435 . . . . 2.31 110.725 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 5.4 mt -106.02 140.06 25.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.03 -0.532 . . . . 1.83 110.544 -179.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.73 135.3 35.17 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 110.124 -0.324 . . . . 2.02 110.124 179.37 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.585 HD11 HG12 ' A' ' 30' ' ' ILE . 34.9 mt -135.3 137.46 42.48 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.946 0.403 . . . . 1.33 111.522 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -105.66 106.77 17.43 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.691 -0.686 . . . . 2.4 109.229 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 4.2 m -138.98 178.19 4.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.176 -0.466 . . . . 1.25 110.713 -179.058 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -127.13 155.75 75.58 Favored Pre-proline 0 C--N 1.32 -0.682 0 N-CA-C 109.442 -0.577 . . . . 1.85 109.442 179.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.605 ' HA ' ' HB2' ' A' ' 56' ' ' LEU . 76.6 Cg_exo -52.34 -29.95 40.93 Favored 'Trans proline' 0 CA--C 1.532 0.378 0 C-N-CA 122.745 2.297 . . . . 1.78 113.017 179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.23 -4.37 50.33 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.399 0.518 . . . . 1.8 112.399 -179.524 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.87 135.64 40.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.743 0.306 . . . . 1.23 110.517 -179.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.91 145.21 31.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.065 -0.516 . . . . 1.44 110.261 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.527 ' HB ' ' HA ' ' A' ' 52' ' ' ASP . 46.6 mm -55.09 -43.76 71.42 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.198 0 O-C-N 123.111 0.257 . . . . 0.99 111.225 -179.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.539 ' HB2' ' HB3' ' A' ' 52' ' ' ASP . 27.6 tt0 -58.63 -38.93 79.13 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.318 -0.401 . . . . 2.22 110.826 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.484 ' O ' ' HG3' ' A' ' 29' ' ' LYS . 64.3 t30 -69.38 -37.34 77.51 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.244 -0.434 . . . . 1.23 109.939 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.439 ' O ' HG13 ' A' ' 30' ' ' ILE . 97.3 t -62.23 -42.71 96.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.966 -0.561 . . . . 0.64 109.826 179.134 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.3 mtmt -62.81 -34.78 78.01 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.033 -0.53 . . . . 1.32 110.815 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.56 -38.76 92.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.037 0.446 . . . . 1.08 109.81 178.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.484 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 48.7 mttt -67.57 -32.5 73.29 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.864 -0.607 . . . . 1.08 110.069 179.278 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.585 HG12 HD11 ' A' ' 15' ' ' LEU . 69.4 mt -69.09 -35.6 69.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.091 -0.504 . . . . 1.31 109.75 179.105 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -65.7 -31.98 73.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.176 -0.465 . . . . 1.93 110.126 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -74.79 -2.5 26.89 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.848 -0.615 . . . . 2.05 110.82 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -121.96 -45.15 2.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.305 -0.407 . . . . 2.17 112.014 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -92.63 -21.84 19.81 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.271 0.471 . . . . 2.14 112.271 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 76.34 19.39 78.34 Favored Glycine 0 CA--C 1.518 0.256 0 C-N-CA 120.57 -0.824 . . . . 2.01 112.115 -179.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.664 HD13 HD21 ' A' ' 71' ' ' LEU . 44.6 mt -104.49 125.73 33.31 Favored Pre-proline 0 C--N 1.327 -0.404 0 N-CA-C 110.337 -0.246 . . . . 1.83 110.337 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.408 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 46.7 Cg_exo -57.8 140.96 95.44 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.835 2.357 . . . . 2.04 112.044 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 37' ' ' PRO . 32.5 Cg_exo -60.11 -18.66 52.44 Favored 'Trans proline' 0 C--N 1.347 0.473 0 C-N-CA 123.126 2.551 . . . . 1.52 112.253 -179.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -63.61 -31.71 72.96 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.835 -0.621 . . . . 2.95 110.843 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -102.61 -0.59 31.74 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.074 -0.512 . . . . 2.56 110.779 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.408 ' HB2' ' HA ' ' A' ' 38' ' ' PRO . 56.3 mt-30 -87.21 120.49 28.55 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.084 -0.507 . . . . 1.4 111.818 -178.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.624 ' HB3' ' HD2' ' B' ' 427' ' ' PHE . 40.8 mtt180 -126.29 124.09 39.55 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.025 -0.731 . . . . 2.65 109.025 178.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.571 ' HB3' HD12 ' A' ' 50' ' ' LEU . 85.1 mt -108.92 129.06 55.42 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.898 0.38 . . . . 1.02 111.022 -179.205 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.688 ' HB ' ' CZ ' ' B' ' 427' ' ' PHE . 1.0 OUTLIER -120.67 144.73 28.61 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 116.062 -0.517 . . . . 2.14 110.366 179.202 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 40.2 t80 -129.64 101.98 6.15 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.887 -0.783 . . . . 1.71 108.887 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.69 34.31 22.09 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.993 -0.549 . . . . 2.1 110.921 -179.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.74 -9.72 76.85 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 121.038 -0.601 . . . . 1.84 113.358 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -88.72 134.19 33.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.892 0.346 . . . . 3.05 111.522 -179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.0 tp-100 -74.82 120.1 19.9 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.512 -0.767 . . . . 2.3 111.232 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.571 HD12 ' HB3' ' A' ' 43' ' ' LEU . 59.1 mt -86.33 110.58 19.76 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.918 -0.401 . . . . 1.17 109.918 179.332 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.543 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 33.1 tt0 -74.67 135.74 41.91 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.219 -0.446 . . . . 2.65 111.308 -179.573 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.539 ' HB3' ' HB2' ' A' ' 24' ' ' GLU . 22.2 m-20 -59.93 -31.48 69.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.673 -0.694 . . . . 1.83 111.624 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.543 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -81.93 7.43 62.99 Favored Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.924 -0.58 . . . . 1.82 113.4 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 17.7 mmt-85 -115.03 167.74 10.54 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 122.577 -0.366 . . . . 2.69 110.257 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 42.3 p -110.12 176.82 4.91 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.768 0.318 . . . . 1.71 110.615 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.605 ' HB2' ' HA ' ' A' ' 19' ' ' PRO . 80.4 mt -65.62 -36.64 84.31 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.282 -0.417 . . . . 1.49 111.785 -179.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.51 -25.09 66.52 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 111.912 0.338 . . . . 1.94 111.912 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -62.46 -34.8 77.54 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.887 0.375 . . . . 2.03 111.126 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -103.87 15.08 29.49 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.006 -0.543 . . . . 1.76 111.518 -179.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 59.45 40.07 21.17 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.436 0.636 . . . . 2.96 111.689 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.459 ' HB ' ' HB3' ' A' ' 56' ' ' LEU . 92.8 mt -83.11 121.66 36.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.929 -0.578 . . . . 1.65 109.883 179.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.5 mt-30 -114.94 -166.23 1.09 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.852 -0.613 . . . . 2.66 110.558 -179.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 42.6 pttt -70.09 148.3 48.93 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.493 -0.321 . . . . 3.22 111.515 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 70.96 0.13 3.27 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 113.149 0.796 . . . . 3.12 113.149 179.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 16.7 m -65.31 140.8 58.72 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.837 0.351 . . . . 1.83 110.393 179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.443 ' HA ' ' O ' ' A' ' 4' ' ' PHE . 3.5 m -104.33 126.92 51.85 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.022 0.439 . . . . 2.03 111.501 -179.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.4 mp -108.0 146.35 32.62 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.801 -0.814 . . . . 1.41 108.801 179.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.655 ' HB2' HG22 ' A' ' 44' ' ' ILE . 44.4 m80 -105.43 134.93 47.74 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.701 0.286 . . . . 2.76 110.845 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 36.4 tp -119.76 115.72 24.47 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.131 -0.486 . . . . 1.54 111.394 -179.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.645 HG22 ' HG ' ' A' ' 8' ' ' LEU . 9.1 t -120.18 129.27 75.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.947 -0.569 . . . . 1.79 109.623 178.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.664 HD21 HD13 ' A' ' 36' ' ' ILE . 58.5 mt -71.5 126.48 29.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.101 -0.499 . . . . 2.43 110.916 -179.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.5 92.63 7.65 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.886 -0.597 . . . . 3.19 110.508 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 84.1 mt -77.72 128.77 34.59 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.276 -0.42 . . . . 2.99 110.799 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 20.4 mmm180 -98.56 -44.92 6.28 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.2 -0.455 . . . . 3.67 110.401 179.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -94.21 91.04 1.4 Allowed Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.685 -0.769 . . . . 3.08 111.799 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.438 -1.201 . . . . 3.82 111.456 -179.851 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.762 0 N-CA-C 112.072 -0.411 . . . . 5.66 112.072 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.65 87.03 7.34 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.123 0.487 . . . . 5.53 110.526 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -87.39 82.82 7.44 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.066 -0.515 . . . . 3.98 111.223 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.09 -25.35 63.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.911 -0.586 . . . . 4.15 110.67 179.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 390' ' ' PHE . . . . . 0.799 ' HB2' HD11 ' B' ' 395' ' ' ILE . 0.1 OUTLIER -119.27 110.71 37.39 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 115.826 -0.625 . . . . 2.51 110.824 -179.992 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -65.35 146.92 86.94 Favored 'Trans proline' 0 C--O 1.234 0.313 0 C-N-CA 122.924 2.416 . . . . 3.77 112.13 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -52.23 -56.55 13.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.488 -0.778 . . . . 5.36 112.917 -178.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -61.51 -43.79 98.24 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.268 -0.424 . . . . 6.89 111.682 -179.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . 0.539 HG23 ' HB2' ' B' ' 419' ' ' ALA . 22.3 m -55.61 -48.6 74.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.976 -0.556 . . . . 4.2 111.439 -179.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 395' ' ' ILE . . . . . 0.799 HD11 ' HB2' ' B' ' 390' ' ' PHE . 84.0 mt -61.62 -50.05 81.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.856 0.36 . . . . 3.8 110.266 179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 82.2 mttt -56.6 -45.43 81.42 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.981 0.734 . . . . 6.27 112.981 -178.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.58 -33.2 75.36 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.871 -0.331 . . . . 6.91 111.519 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 84.6 mt -78.74 -25.25 44.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.849 0.356 . . . . 4.31 111.268 179.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 399' ' ' MET . . . . . 0.595 ' HG2' ' O ' ' B' ' 395' ' ' ILE . 31.7 mmt -73.92 -24.87 59.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.072 0.463 . . . . 5.8 109.891 179.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -61.27 -30.19 70.31 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.516 -0.765 . . . . 7.71 111.366 -179.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 401' ' ' LEU . . . . . 0.548 ' HB2' ' HD2' ' B' ' 403' ' ' PHE . 9.8 mt -65.4 -15.35 62.5 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 115.955 -0.566 . . . . 5.69 111.443 -179.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 98.0 39.25 3.86 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.735 -0.745 . . . . 5.87 112.082 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 403' ' ' PHE . . . . . 0.548 ' HD2' ' HB2' ' B' ' 401' ' ' LEU . 78.8 m-85 -120.12 154.84 56.02 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-O 120.413 0.149 . . . . 4.83 110.714 -179.725 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -78.79 158.19 27.87 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.526 2.151 . . . . 4.72 112.386 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.594 ' O ' HG12 ' B' ' 408' ' ' VAL . 11.4 ttt85 -63.8 -32.01 73.37 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.834 -0.621 . . . . 4.16 110.838 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -61.46 -40.3 94.03 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.956 0.408 . . . . 4.69 110.54 179.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -65.77 -39.01 90.58 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.77 -0.65 . . . . 2.99 111.37 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 408' ' ' VAL . . . . . 0.594 HG12 ' O ' ' B' ' 405' ' ' ARG . 1.4 p -66.44 -35.03 73.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 C-N-CA 120.896 -0.322 . . . . 2.06 111.367 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 409' ' ' VAL . . . . . 0.426 HG23 ' O ' ' B' ' 405' ' ' ARG . 84.8 t -67.14 -44.62 87.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 120.99 0.424 . . . . 2.89 109.892 179.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -62.96 -47.06 84.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.812 -0.631 . . . . 5.05 110.587 179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -63.94 -45.83 87.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.894 -0.594 . . . . 2.96 110.859 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.94 HD13 ' HA2' ' B' ' 417' ' ' GLY . 0.1 OUTLIER -59.77 -51.44 69.73 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.432 0.531 . . . . 3.45 112.432 -179.262 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 5.9 mtpm? -60.51 -31.47 70.54 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.459 0.541 . . . . 5.52 112.459 -179.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -87.86 -18.85 28.32 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 113.362 0.875 . . . . 5.53 113.362 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 35.0 p -107.62 3.99 25.4 Favored 'General case' 0 C--O 1.236 0.36 0 O-C-N 121.858 -0.526 . . . . 5.42 111.77 -178.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 67.71 50.83 0.85 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.869 -0.605 . . . . 6.37 111.202 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.94 ' HA2' HD13 ' B' ' 412' ' ' LEU . . . 66.15 -27.33 0.16 Allowed Glycine 0 CA--C 1.528 0.848 0 N-CA-C 117.373 1.709 . . . . 4.33 117.373 176.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -58.9 113.98 2.33 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 118.588 1.194 . . . . 6.25 113.199 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 419' ' ' ALA . . . . . 0.539 ' HB2' HG23 ' B' ' 394' ' ' THR . . . -61.02 -26.01 67.3 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.33 -0.85 . . . . 4.12 113.252 -178.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 420' ' ' GLU . . . . . 0.402 ' H ' ' HG2' ' B' ' 420' ' ' GLU . 5.2 mm-40 -59.24 -56.35 23.29 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.585 0.707 . . . . 6.99 110.667 -179.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -74.95 -29.79 61.03 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.769 -0.65 . . . . 7.48 110.43 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 422' ' ' ALA . . . . . 0.466 ' HB3' ' HA ' ' B' ' 419' ' ' ALA . . . -60.47 -48.53 81.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.702 -0.681 . . . . 3.68 110.193 179.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.518 ' O ' ' HB2' ' B' ' 427' ' ' PHE . . . -62.81 -38.78 92.06 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.873 -0.603 . . . . 3.8 110.006 179.212 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 69.0 m -64.28 -31.53 72.77 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.038 -0.528 . . . . 5.05 110.731 178.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 425' ' ' LEU . . . . . 0.619 ' O ' ' HG2' ' B' ' 428' ' ' GLN . 1.1 mm? -81.9 -48.94 10.91 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 112.903 0.705 . . . . 4.36 112.903 -179.316 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.5 pp -64.02 -33.21 75.22 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.768 0.655 . . . . 3.21 112.768 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 427' ' ' PHE . . . . . 0.688 ' CZ ' ' HB ' ' A' ' 44' ' ' ILE . 0.2 OUTLIER -69.3 -1.24 7.64 Favored 'General case' 0 CA--C 1.53 0.212 0 N-CA-C 113.893 1.071 . . . . 5.27 113.893 -179.052 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 428' ' ' GLN . . . . . 0.619 ' HG2' ' O ' ' B' ' 425' ' ' LEU . 11.8 pt20 -113.89 23.45 13.0 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.499 0.555 . . . . 5.32 112.499 179.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 13.3 m . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.584 -0.722 . . . . 5.11 110.302 179.526 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ptt? . . . . . 0 N--CA 1.482 1.152 0 N-CA-C 110.179 -0.304 . . . . 1.65 110.179 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 46.0 mm-40 -107.84 142.62 37.63 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.583 0.23 . . . . 1.92 110.796 -179.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 18.1 pt -130.89 153.75 39.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.399 -0.364 . . . . 1.48 110.258 179.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -105.16 119.54 39.3 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.544 -0.298 . . . . 2.17 110.597 -179.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.42 ' O ' ' HA ' ' A' ' 12' ' ' THR . 21.3 t -103.16 119.35 51.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 110.027 -0.36 . . . . 1.65 110.027 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -103.12 131.74 49.91 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.266 -0.424 . . . . 3.16 110.983 -179.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.71 161.5 13.57 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.139 -0.482 . . . . 2.17 109.877 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.502 HD11 HG13 ' A' ' 70' ' ' VAL . 78.0 mt -59.39 -23.6 62.74 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.258 0.466 . . . . 3.05 112.258 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -79.91 -8.08 59.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.98 0.419 . . . . 2.7 111.699 -179.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 98.12 3.01 57.97 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.765 -0.731 . . . . 2.64 111.968 -179.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -75.44 146.47 40.69 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.457 -0.571 . . . . 2.34 109.457 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.42 ' HA ' ' O ' ' A' ' 5' ' ' VAL . 2.2 m -139.26 119.71 13.92 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.726 0.298 . . . . 2.31 110.897 -179.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 24.4 pt -119.33 148.83 22.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.537 -0.301 . . . . 1.83 110.818 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 6.6 m -103.91 111.64 24.26 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.918 0.389 . . . . 2.02 110.391 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.422 HD21 ' HG3' ' A' ' 33' ' ' LYS . 72.5 mt -104.47 152.39 22.4 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.22 -0.445 . . . . 1.33 111.126 -179.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -98.96 121.23 40.65 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.882 -0.599 . . . . 2.4 110.739 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 5.8 m -138.5 163.58 28.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 116.158 -0.474 . . . . 1.25 110.684 -179.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.541 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 20.5 mm-40 -117.94 158.3 46.25 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 116.034 -0.53 . . . . 1.85 109.778 179.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -58.29 -23.65 63.75 Favored 'Trans proline' 0 N--CA 1.475 0.405 0 C-N-CA 122.607 2.205 . . . . 1.78 112.388 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -92.71 3.76 55.01 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.171 -0.468 . . . . 1.8 111.599 -179.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.541 ' HB2' ' O ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -77.45 130.46 37.05 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-O 120.833 0.349 . . . . 1.23 110.916 -179.69 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.22 155.23 27.46 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.131 -0.692 . . . . 1.44 109.131 178.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.596 ' HB ' ' HA ' ' A' ' 52' ' ' ASP . 43.7 mm -58.59 -38.18 69.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-O 120.518 0.199 . . . . 0.99 111.347 -179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -60.62 -34.91 74.95 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 121.114 0.483 . . . . 2.22 110.3 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.423 ' O ' ' HG3' ' A' ' 29' ' ' LYS . 8.4 m-20 -65.0 -36.14 83.45 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 115.98 -0.555 . . . . 1.23 110.377 179.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 22.0 t -66.04 -38.63 82.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.076 -0.511 . . . . 0.64 109.648 179.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.448 ' HG2' ' O ' ' A' ' 23' ' ' ILE . 4.5 mmmm -61.0 -40.9 95.29 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.723 -0.671 . . . . 1.32 109.948 179.369 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.67 -36.08 82.63 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.638 -0.71 . . . . 1.08 110.588 179.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.423 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 87.4 mttt -68.52 -39.93 81.0 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.423 -0.353 . . . . 1.08 110.47 179.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 81.7 mt -66.8 -36.32 76.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 109.41 -0.589 . . . . 1.31 109.41 178.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.2 tt0 -66.82 -33.48 75.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.76 -0.654 . . . . 1.93 110.038 179.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -69.41 -34.56 74.66 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.699 -0.682 . . . . 2.05 110.821 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.422 ' HG3' HD21 ' A' ' 15' ' ' LEU . 74.3 mmtt -84.88 -61.46 1.77 Allowed 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.581 0.585 . . . . 2.17 112.581 -179.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -80.73 -45.94 16.29 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 113.089 0.774 . . . . 2.14 113.089 -177.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 99.33 25.44 9.42 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.517 -0.849 . . . . 2.01 111.576 -178.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 71.9 mt -98.62 127.66 35.1 Favored Pre-proline 0 C--N 1.326 -0.451 0 N-CA-C 109.617 -0.512 . . . . 1.83 109.617 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.424 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 77.5 Cg_exo -50.97 133.41 40.42 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.991 2.461 . . . . 2.04 112.104 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 37' ' ' PRO . 32.2 Cg_exo -59.53 -19.68 53.42 Favored 'Trans proline' 0 C--N 1.344 0.29 0 C-N-CA 123.338 2.692 . . . . 1.52 112.625 -179.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -21.14 58.52 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.349 -0.387 . . . . 2.95 110.92 179.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -98.14 -13.9 20.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.139 0.495 . . . . 2.56 110.373 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -78.84 122.83 26.57 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.809 -0.632 . . . . 1.4 111.951 -179.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.453 ' HD2' ' OE1' ' A' ' 49' ' ' GLN . 14.1 mmt85 -121.44 107.61 12.67 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.189 -0.671 . . . . 2.65 109.189 177.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.807 ' HB3' HD12 ' A' ' 50' ' ' LEU . 69.7 mt -91.87 125.47 36.59 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.084 -0.507 . . . . 1.02 112.309 -178.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.631 ' HB ' ' HB2' ' A' ' 68' ' ' HIS . 43.9 mt -117.23 146.18 22.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.639 -0.709 . . . . 2.14 109.816 179.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -132.8 93.16 3.16 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.39 -0.368 . . . . 1.71 110.36 179.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 56.29 50.46 13.27 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 113.002 0.741 . . . . 2.1 113.002 179.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.417 ' HA2' ' HA3' ' B' ' 402' ' ' GLY . . . 96.63 -38.69 3.01 Favored Glycine 0 CA--C 1.517 0.172 0 C-N-CA 120.721 -0.752 . . . . 1.84 113.525 179.193 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -85.8 153.27 22.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.67 0.235 . . . . 3.05 110.513 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.453 ' OE1' ' HD2' ' A' ' 42' ' ' ARG . 9.9 tt0 -97.77 145.57 26.24 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.998 0.428 . . . . 2.3 111.031 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.807 HD12 ' HB3' ' A' ' 43' ' ' LEU . 73.0 mt -89.71 122.97 33.32 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.652 -0.703 . . . . 1.17 110.441 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.581 ' HB3' ' HG2' ' A' ' 54' ' ' ARG . 0.1 OUTLIER -88.83 130.14 35.44 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.094 -0.503 . . . . 2.65 110.225 -179.721 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.596 ' HA ' ' HB ' ' A' ' 23' ' ' ILE . 35.7 m-20 -54.69 -28.31 46.75 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 112.045 0.387 . . . . 1.83 112.045 -179.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -85.38 10.86 62.65 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.918 -0.658 . . . . 1.82 113.231 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.581 ' HG2' ' HB3' ' A' ' 51' ' ' GLU . 81.6 mmt-85 -115.75 169.92 8.84 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 117.011 0.405 . . . . 2.69 110.866 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 25.9 p -111.61 166.16 11.39 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.773 -0.649 . . . . 1.71 109.638 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.456 HD12 ' O ' ' A' ' 18' ' ' GLU . 83.7 mt -64.16 -28.45 69.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.067 0.461 . . . . 1.49 110.942 179.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.8 m -73.08 -19.59 61.13 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.866 -0.606 . . . . 1.94 111.698 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -66.7 -34.22 77.36 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.103 0.478 . . . . 2.03 110.65 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.41 ' HB2' HG13 ' A' ' 61' ' ' ILE . 60.3 m-85 -101.69 8.95 41.41 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.807 -0.633 . . . . 1.76 109.934 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 53.37 49.71 19.12 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.653 -0.703 . . . . 2.96 110.512 -179.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.41 HG13 ' HB2' ' A' ' 59' ' ' TYR . 79.8 mt -81.67 106.88 13.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.47 -0.786 . . . . 1.65 110.003 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -84.76 177.98 7.81 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.718 -0.674 . . . . 2.66 110.399 -179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.87 148.66 51.64 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.199 -0.455 . . . . 3.22 110.173 179.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 74.17 8.69 4.63 Favored 'General case' 0 N--CA 1.467 0.425 0 N-CA-C 113.065 0.765 . . . . 3.12 113.065 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 70.6 m -70.94 150.35 45.8 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 122.13 -0.357 . . . . 1.83 110.958 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.6 m -104.14 127.71 51.76 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.047 0.451 . . . . 2.03 111.109 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 10.8 mp -111.08 145.75 38.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.669 -0.696 . . . . 1.41 109.314 179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.631 ' HB2' ' HB ' ' A' ' 44' ' ' ILE . 65.3 m80 -102.74 129.7 49.45 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.749 0.309 . . . . 2.76 111.631 -179.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 51.6 tp -110.12 105.68 14.86 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.945 -0.571 . . . . 1.54 110.483 179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.502 HG13 HD11 ' A' ' 8' ' ' LEU . 62.6 t -98.01 137.0 26.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-N 115.884 -0.598 . . . . 1.79 110.424 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 66.9 mt -86.62 107.95 18.4 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.047 -0.524 . . . . 2.43 109.625 179.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.479 HH21 ' HA ' ' B' ' 428' ' ' GLN . 0.4 OUTLIER -104.13 95.3 5.88 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.241 -0.436 . . . . 3.19 111.037 -179.404 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 42.7 mt -80.56 161.7 24.65 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.045 -0.525 . . . . 2.99 109.625 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 9.1 mmt180 -104.77 7.75 34.73 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.856 0.36 . . . . 3.67 110.994 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -174.19 -170.68 37.76 Favored Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 111.135 -0.786 . . . . 3.08 111.135 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.827 -0.985 . . . . 3.82 111.507 -179.882 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.826 0 N-CA-C 111.864 -0.495 . . . . 5.66 111.864 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 35.5 m -143.0 39.88 1.48 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.124 0.488 . . . . 5.53 110.72 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -73.93 105.11 5.04 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.9 -0.591 . . . . 3.98 111.056 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.15 -18.72 52.62 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.956 -0.566 . . . . 4.15 110.549 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 390' ' ' PHE . . . . . 0.587 ' HD1' HD11 ' B' ' 395' ' ' ILE . 0.5 OUTLIER -141.62 112.23 6.43 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.868 -0.606 . . . . 2.51 110.721 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 391' ' ' PRO . . . . . 0.454 ' O ' HG13 ' B' ' 395' ' ' ILE . 32.0 Cg_exo -60.16 149.98 81.98 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 122.87 2.38 . . . . 3.77 112.421 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -53.51 -46.45 70.09 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.651 -0.704 . . . . 5.36 112.719 -179.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 393' ' ' GLN . . . . . 0.511 ' O ' ' HG2' ' B' ' 397' ' ' GLN . 5.5 tt0 -54.88 -51.29 66.43 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.828 0.347 . . . . 6.89 111.499 -179.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -39.72 86.86 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.948 -0.569 . . . . 4.2 111.736 -179.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 395' ' ' ILE . . . . . 0.587 HD11 ' HD1' ' B' ' 390' ' ' PHE . 73.3 mt -61.71 -51.36 73.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-O 120.884 0.373 . . . . 3.8 109.996 179.63 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -55.12 -33.68 63.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.788 -0.642 . . . . 6.27 112.57 -179.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 397' ' ' GLN . . . . . 0.511 ' HG2' ' O ' ' B' ' 393' ' ' GLN . 19.9 mm-40 -69.32 -53.57 18.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.941 0.4 . . . . 6.91 110.822 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 88.8 mt -67.57 -29.45 68.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.023 -0.535 . . . . 4.31 112.3 -178.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 399' ' ' MET . . . . . . . . . . . . . 28.6 mmt -68.96 -27.57 65.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.62 0.248 . . . . 5.8 111.45 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -71.45 -19.57 62.21 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.044 -0.525 . . . . 7.71 111.537 -179.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 47.5 mt -69.62 -26.53 64.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.231 -0.441 . . . . 5.69 110.966 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 402' ' ' GLY . . . . . 0.417 ' HA3' ' HA2' ' A' ' 47' ' ' GLY . . . 112.83 6.75 22.67 Favored Glycine 0 N--CA 1.453 -0.172 0 C-N-CA 120.685 -0.769 . . . . 5.87 112.567 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -89.64 150.14 43.62 Favored Pre-proline 0 C--N 1.328 -0.354 0 N-CA-C 110.393 -0.225 . . . . 4.83 110.393 179.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -72.65 156.47 53.52 Favored 'Trans proline' 0 C--O 1.236 0.393 0 C-N-CA 122.457 2.105 . . . . 4.72 111.347 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.422 HH11 ' HD3' ' B' ' 405' ' ' ARG . 36.3 ttt-85 -60.65 -30.7 70.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.51 -0.314 . . . . 4.16 111.498 -179.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -58.89 -38.69 79.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.332 -0.395 . . . . 4.69 110.844 179.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -62.37 -38.56 90.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.968 -0.56 . . . . 2.99 110.041 179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 408' ' ' VAL . . . . . 0.672 HG13 HD23 ' B' ' 412' ' ' LEU . 2.6 t -65.33 -43.53 94.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.898 -0.592 . . . . 2.06 110.647 179.59 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 409' ' ' VAL . . . . . 0.412 ' O ' ' HB2' ' B' ' 413' ' ' LYS . 48.7 t -57.06 -49.03 80.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.248 -0.433 . . . . 2.89 110.45 179.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 75.6 mttt -68.08 -48.0 66.72 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.94 -0.573 . . . . 5.05 111.717 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -60.75 -50.71 72.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.321 0.489 . . . . 2.96 112.321 -179.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.672 HD23 HG13 ' B' ' 408' ' ' VAL . 3.8 mm? -65.17 -30.83 71.78 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.466 0.543 . . . . 3.45 112.466 -178.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 413' ' ' LYS . . . . . 0.412 ' HB2' ' O ' ' B' ' 409' ' ' VAL . 6.8 mmtt -68.84 -37.97 79.5 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 111.83 0.308 . . . . 5.52 111.83 -179.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 29.2 pt20 -87.68 -8.13 56.52 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 113.018 0.748 . . . . 5.53 113.018 -179.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 415' ' ' THR . . . . . 0.532 HG21 ' HA ' ' B' ' 422' ' ' ALA . 25.1 p -109.22 -19.39 13.34 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 120.934 0.397 . . . . 5.42 111.574 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 68.3 62.1 0.38 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 113.19 0.811 . . . . 6.37 113.19 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 79.44 -23.34 3.47 Favored Glycine 0 CA--C 1.521 0.465 0 N-CA-C 115.547 0.979 . . . . 4.33 115.547 177.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 39.8 t-20 -65.94 103.33 0.91 Allowed 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 117.585 0.692 . . . . 6.25 110.546 -179.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -67.13 -38.72 86.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.914 -0.585 . . . . 4.12 111.614 -179.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -66.24 -38.74 88.6 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-O 121.299 0.571 . . . . 6.99 110.018 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -72.92 -36.01 67.17 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.876 -0.787 . . . . 7.48 108.876 178.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 422' ' ' ALA . . . . . 0.532 ' HA ' HG21 ' B' ' 415' ' ' THR . . . -62.69 -43.25 99.29 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.734 -0.666 . . . . 3.68 110.161 178.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.481 ' HB1' ' CG1' ' A' ' 70' ' ' VAL . . . -61.16 -38.18 85.54 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.215 0.531 . . . . 3.8 110.151 179.282 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 17.7 m -72.35 -34.85 68.31 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.53 -0.759 . . . . 5.05 110.45 178.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -71.53 -46.12 60.48 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.993 -0.548 . . . . 4.36 111.715 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.7 pp -65.41 -34.08 77.45 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.107 0.479 . . . . 3.21 111.136 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 427' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -77.16 2.88 14.03 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 113.405 0.891 . . . . 5.27 113.405 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 428' ' ' GLN . . . . . 0.479 ' HA ' HH21 ' A' ' 72' ' ' ARG . 2.5 pt20 -57.66 -23.42 51.24 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 120.799 0.333 . . . . 5.32 110.76 178.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.667 -0.682 . . . . 5.11 110.276 179.699 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.455 ' HB2' ' HB3' ' A' ' 63' ' ' LYS . 26.1 ptt? . . . . . 0 N--CA 1.483 1.209 0 CA-C-O 120.569 0.223 . . . . 1.65 110.694 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 71.0 mm-40 -112.48 145.31 40.44 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.901 0.381 . . . . 1.92 111.953 -179.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 20.2 pt -130.12 155.04 41.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 115.993 -0.549 . . . . 1.48 109.54 178.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -111.14 115.14 28.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.736 0.303 . . . . 2.17 110.899 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 39.6 t -99.97 119.79 48.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.389 -0.368 . . . . 1.65 110.615 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.7 ' HE3' HG21 ' A' ' 66' ' ' THR . 89.5 mttt -94.57 128.98 41.56 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.299 -0.41 . . . . 3.16 110.566 179.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.22 163.65 12.31 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.206 -0.452 . . . . 2.17 110.088 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 27.9 mt -62.85 -20.8 65.44 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 120.937 0.399 . . . . 3.05 111.72 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 1.3 p -81.84 -3.76 54.83 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.245 -0.434 . . . . 2.7 110.846 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 92.78 -6.87 77.19 Favored Glycine 0 C--N 1.335 0.492 0 N-CA-C 111.369 -0.692 . . . . 2.64 111.369 -179.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -68.32 149.67 49.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.35 -0.425 . . . . 2.34 110.811 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.3 m -126.19 128.37 47.14 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.366 -0.605 . . . . 2.31 109.366 178.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 12.2 mt -113.35 129.45 69.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.651 -0.25 . . . . 1.83 111.461 -178.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.96 110.03 22.31 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.995 -0.743 . . . . 2.02 108.995 178.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.7 mt -114.77 142.05 47.05 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.513 0.56 . . . . 1.33 112.513 -178.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -84.44 120.24 26.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.423 -0.808 . . . . 2.4 109.401 179.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 15.3 m -142.34 178.8 2.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 116.146 -0.479 . . . . 1.25 109.998 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 21.6 mm-40 -145.71 163.26 32.3 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 109.019 -0.734 . . . . 1.85 109.019 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -55.82 -27.04 60.41 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.418 2.078 . . . . 1.78 112.758 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.07 11.44 18.44 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.301 -0.409 . . . . 1.8 111.78 -179.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -86.66 134.17 33.63 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 110.031 -0.359 . . . . 1.23 110.031 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.41 ' O ' HG23 ' A' ' 26' ' ' VAL . 0.7 OUTLIER -92.36 148.69 21.92 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.38 -0.373 . . . . 1.44 110.698 -179.96 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.607 ' HB ' ' HA ' ' A' ' 52' ' ' ASP . 44.8 mm -55.36 -41.1 60.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.376 -0.374 . . . . 0.99 111.792 -179.59 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -65.17 -30.04 70.92 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 120.881 0.372 . . . . 2.22 111.266 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -76.2 -37.21 58.09 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.586 -0.524 . . . . 1.23 109.586 179.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 22' ' ' THR . 66.8 t -64.76 -37.13 79.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.854 -0.612 . . . . 0.64 109.922 178.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -60.52 -37.1 80.07 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 115.79 -0.641 . . . . 1.32 111.074 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.29 -36.66 84.4 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 1.08 110.282 179.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 87.0 mttt -65.72 -38.23 88.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.835 -0.62 . . . . 1.08 110.265 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 47.3 mt -70.32 -30.95 45.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.176 -0.465 . . . . 1.31 110.312 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -71.09 -34.54 71.25 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.96 0.409 . . . . 1.93 110.205 179.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -72.59 -33.68 66.9 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.145 0.497 . . . . 2.05 110.681 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -83.62 -63.11 1.41 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.026 -0.534 . . . . 2.17 112.43 -179.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -79.7 -48.61 13.39 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.479 0.548 . . . . 2.14 112.479 -178.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 115.8 -12.2 17.94 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.707 -0.759 . . . . 2.01 111.727 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.424 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 13.0 mt -68.57 124.29 89.67 Favored Pre-proline 0 C--N 1.326 -0.443 0 N-CA-C 110.338 -0.245 . . . . 1.83 110.338 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.443 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 33.6 Cg_exo -63.12 143.62 90.65 Favored 'Trans proline' 0 C--O 1.233 0.274 0 C-N-CA 122.84 2.36 . . . . 2.04 111.457 179.275 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 37' ' ' PRO . 50.0 Cg_exo -56.7 -23.64 50.57 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.332 2.688 . . . . 1.52 112.297 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.96 -23.41 65.95 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.97 -0.559 . . . . 2.95 110.612 179.55 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.403 ' HA ' ' HB3' ' A' ' 72' ' ' ARG . 32.9 mt-30 -112.06 9.37 20.33 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.955 -0.566 . . . . 2.56 110.543 -179.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 68.3 mt-30 -97.0 100.16 11.68 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.767 -0.651 . . . . 1.4 111.244 -179.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 52.4 mtp180 -104.46 103.89 13.66 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 109.05 -0.722 . . . . 2.65 109.05 178.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.3 mp -104.51 144.1 32.14 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.885 0.698 . . . . 1.02 112.885 -178.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.596 HG13 ' HB2' ' A' ' 68' ' ' HIS . 1.0 OUTLIER -135.44 151.37 30.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 115.36 -0.836 . . . . 2.14 110.268 179.048 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.481 ' HB2' HD21 ' A' ' 50' ' ' LEU . 61.6 t80 -121.02 87.74 2.81 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.104 -0.702 . . . . 1.71 109.104 178.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 56.1 65.86 1.34 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.826 -0.625 . . . . 2.1 111.946 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 76.13 -9.28 19.86 Favored Glycine 0 CA--C 1.521 0.467 0 CA-C-N 115.801 -0.636 . . . . 1.84 114.301 179.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.424 ' HE2' ' O ' ' A' ' 45' ' ' PHE . 27.3 mtmm -100.88 124.61 46.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 117.25 0.525 . . . . 3.05 111.192 -179.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -75.43 134.55 40.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.25 -0.432 . . . . 2.3 110.489 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.481 HD21 ' HB2' ' A' ' 45' ' ' PHE . 36.8 mt -93.07 125.56 37.72 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.295 -0.411 . . . . 1.17 111.24 -179.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.428 ' HG2' ' H ' ' A' ' 53' ' ' GLY . 32.3 tt0 -89.11 132.16 34.93 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.81 -0.441 . . . . 2.65 109.81 179.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.607 ' HA ' ' HB ' ' A' ' 23' ' ' ILE . 24.0 m-20 -56.19 -30.66 62.57 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.974 0.731 . . . . 1.83 112.974 -178.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.428 ' H ' ' HG2' ' A' ' 51' ' ' GLU . . . -87.72 18.23 40.22 Favored Glycine 0 CA--C 1.519 0.286 0 C-N-CA 120.948 -0.644 . . . . 1.82 113.356 -179.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 22.4 mmm-85 -120.28 163.61 17.55 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.966 0.383 . . . . 2.69 111.099 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.472 ' O ' ' HB2' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -103.42 169.19 8.68 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.674 -0.694 . . . . 1.71 110.211 179.753 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.444 ' HB3' ' HB ' ' A' ' 61' ' ' ILE . 72.8 mt -63.33 -33.84 76.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.824 0.345 . . . . 1.49 111.527 179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.08 -19.1 65.74 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.188 -0.46 . . . . 1.94 111.329 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.472 ' HB2' ' O ' ' A' ' 55' ' ' THR . 1.5 m-20 -65.38 -31.15 72.11 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 116.233 -0.439 . . . . 2.03 111.548 -179.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.444 ' HB2' HG13 ' A' ' 61' ' ' ILE . 47.1 m-85 -111.91 14.23 20.91 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.287 -0.415 . . . . 1.76 110.407 -179.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 48.8 t30 59.67 34.14 22.08 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.455 -0.793 . . . . 2.96 111.289 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.444 ' HB ' ' HB3' ' A' ' 56' ' ' LEU . 72.7 mt -75.66 109.8 9.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.848 -0.615 . . . . 1.65 109.725 179.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -106.14 -166.6 1.21 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.871 -0.604 . . . . 2.66 110.685 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.455 ' HB3' ' HB2' ' A' ' 1' ' ' MET . 8.3 pttm -68.95 145.26 53.78 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.409 -0.359 . . . . 3.22 110.993 179.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 71.74 8.34 6.09 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.495 0.924 . . . . 3.12 113.495 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.436 ' HB3' ' HE1' ' A' ' 45' ' ' PHE . 28.1 m -72.03 143.31 49.19 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.754 0.312 . . . . 1.83 110.262 179.22 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.7 HG21 ' HE3' ' A' ' 6' ' ' LYS . 0.2 OUTLIER -100.43 125.7 46.75 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.192 -0.458 . . . . 2.03 111.21 -179.666 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.0 mp -114.54 146.14 41.1 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.491 -0.929 . . . . 1.41 108.491 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.596 ' HB2' HG13 ' A' ' 44' ' ' ILE . 63.8 m80 -109.63 137.63 47.17 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 120.726 0.298 . . . . 2.76 111.56 -179.046 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 52.0 tp -118.35 116.48 26.83 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.934 -0.575 . . . . 1.54 111.128 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 22.9 t -98.71 129.28 49.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.691 -0.686 . . . . 1.79 109.648 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 58.3 mt -76.06 117.74 18.09 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.769 -0.65 . . . . 2.43 111.106 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.403 ' HB3' ' HA ' ' A' ' 40' ' ' GLN . 60.3 ttt180 -93.27 103.15 15.42 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.832 -0.622 . . . . 3.19 110.815 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 34.9 mt -78.8 120.88 24.07 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.099 -0.501 . . . . 2.99 110.71 179.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 -83.71 -49.58 8.99 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.255 -0.429 . . . . 3.67 110.669 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -133.45 113.99 1.3 Allowed Glycine 0 N--CA 1.445 -0.738 0 C-N-CA 120.723 -0.751 . . . . 3.08 111.675 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.521 -1.155 . . . . 3.82 111.304 179.688 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.355 0 N-CA-C 111.821 -0.512 . . . . 5.66 111.821 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -84.09 54.67 3.02 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.177 0.513 . . . . 5.53 110.517 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -83.65 71.79 10.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.006 -0.543 . . . . 3.98 110.564 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.3 -31.79 70.5 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.639 -0.709 . . . . 4.15 111.049 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 390' ' ' PHE . . . . . 0.406 ' HA ' ' HD3' ' B' ' 391' ' ' PRO . 26.0 m-85 -109.69 121.1 43.16 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 115.865 -0.607 . . . . 2.51 110.439 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 391' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' B' ' 390' ' ' PHE . 15.3 Cg_exo -70.04 130.87 19.71 Favored 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.792 2.328 . . . . 3.77 111.359 179.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -50.67 -49.22 57.72 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.886 0.699 . . . . 5.36 112.886 -179.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -60.22 -42.15 94.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.437 -0.347 . . . . 6.89 111.086 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 11.2 m -63.74 -43.4 96.59 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.037 -0.528 . . . . 4.2 110.969 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 395' ' ' ILE . . . . . . . . . . . . . 84.8 mt -59.14 -49.27 83.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.493 -0.321 . . . . 3.8 110.685 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 92.1 mttt -61.51 -42.95 99.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.007 -0.542 . . . . 6.27 111.281 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -64.6 -44.67 89.87 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.777 0.322 . . . . 6.91 111.217 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 98.1 mt -66.59 -37.97 86.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.141 -0.481 . . . . 4.31 111.717 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 399' ' ' MET . . . . . 0.401 ' HA ' ' O ' ' B' ' 403' ' ' PHE . 39.0 mtp -67.51 -32.79 73.83 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.459 -0.337 . . . . 5.8 111.397 179.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -65.66 -28.55 69.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.267 -0.424 . . . . 7.71 111.215 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 401' ' ' LEU . . . . . 0.432 HD22 ' HB3' ' A' ' 68' ' ' HIS . 14.3 mt -64.97 -18.46 65.29 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.131 0.491 . . . . 5.69 110.681 179.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 107.91 23.28 6.85 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.76 -0.655 . . . . 5.87 111.524 -179.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 403' ' ' PHE . . . . . 0.401 ' O ' ' HA ' ' B' ' 399' ' ' MET . 39.9 m-85 -114.38 139.44 23.88 Favored Pre-proline 0 C--N 1.323 -0.545 0 CA-C-O 120.768 0.318 . . . . 4.83 110.806 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -77.16 164.39 29.39 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 122.671 2.248 . . . . 4.72 112.056 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 56.3 mtt180 -60.11 -28.06 67.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.835 -0.62 . . . . 4.16 110.798 179.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -58.07 -44.65 87.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.712 -0.676 . . . . 4.69 110.675 179.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -67.66 -36.3 80.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.635 -0.711 . . . . 2.99 110.117 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 91.0 t -60.96 -53.27 51.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.659 -0.7 . . . . 2.06 110.521 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 88.1 t -54.8 -49.51 68.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 116.136 -0.484 . . . . 2.89 112.046 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -66.23 -49.51 66.98 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.747 0.647 . . . . 5.05 112.747 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 411' ' ' ALA . . . . . 0.595 ' HA ' HE21 ' B' ' 414' ' ' GLN . . . -64.16 -48.5 75.76 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.374 0.509 . . . . 2.96 112.374 -178.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -62.72 -39.82 95.24 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.463 0.542 . . . . 3.45 112.463 -178.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 13.4 mmmt -64.26 -42.29 96.53 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.147 0.425 . . . . 5.52 112.147 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 414' ' ' GLN . . . . . 0.595 HE21 ' HA ' ' B' ' 411' ' ' ALA . 30.0 pt20 -77.87 -8.91 58.71 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.478 0.547 . . . . 5.53 112.478 -179.21 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 25.3 p -113.3 8.23 17.99 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.754 0.311 . . . . 5.42 111.63 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 61.33 39.78 15.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.071 -0.513 . . . . 6.37 112.362 179.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 79.7 -15.68 13.56 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.715 -0.755 . . . . 4.33 114.194 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 418' ' ' ASN . . . . . 0.78 HD21 ' HB2' ' B' ' 421' ' ' PHE . 0.1 OUTLIER -67.9 106.06 2.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 117.973 0.886 . . . . 6.25 110.99 -179.916 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 419' ' ' ALA . . . . . 0.453 ' HA ' ' HB3' ' B' ' 422' ' ' ALA . . . -62.59 -25.8 68.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 114.969 -1.014 . . . . 4.12 112.903 -178.241 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -60.18 -56.4 22.09 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.2 0.524 . . . . 6.99 110.69 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 421' ' ' PHE . . . . . 0.78 ' HB2' HD21 ' B' ' 418' ' ' ASN . 23.4 m-85 -73.86 -29.27 62.02 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.081 -0.509 . . . . 7.48 110.415 179.61 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 422' ' ' ALA . . . . . 0.453 ' HB3' ' HA ' ' B' ' 419' ' ' ALA . . . -61.4 -46.56 89.65 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.297 -0.41 . . . . 3.68 110.557 179.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -64.78 -38.52 91.28 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.982 -0.554 . . . . 3.8 110.381 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 1.3 t -70.1 -26.15 63.84 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.13 -0.486 . . . . 5.05 110.503 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 425' ' ' LEU . . . . . 0.474 ' O ' ' HG2' ' B' ' 428' ' ' GLN . 0.5 OUTLIER -79.56 -49.77 11.72 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 116.095 -0.502 . . . . 4.36 111.401 179.961 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.2 pp -61.46 -33.19 73.34 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.132 0.419 . . . . 3.21 112.132 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 427' ' ' PHE . . . . . 0.595 ' CZ ' HG23 ' A' ' 44' ' ' ILE . 1.4 t80 -61.84 -12.51 17.84 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 112.871 0.693 . . . . 5.27 112.871 -179.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 428' ' ' GLN . . . . . 0.474 ' HG2' ' O ' ' B' ' 425' ' ' LEU . 3.2 pt20 -67.7 -7.53 27.81 Favored 'General case' 0 C--O 1.235 0.314 0 O-C-N 122.216 -0.302 . . . . 5.32 111.51 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.654 -0.689 . . . . 5.11 110.511 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.523 ' HG2' ' O ' ' A' ' 17' ' ' VAL . 23.0 ptt? . . . . . 0 N--CA 1.476 0.859 0 CA-C-O 120.867 0.365 . . . . 1.65 110.492 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.498 ' HA ' ' O ' ' A' ' 15' ' ' LEU . 65.3 mm-40 -87.01 142.4 27.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.935 0.398 . . . . 1.92 111.296 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 27.6 pt -127.58 162.51 32.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-N 115.862 -0.608 . . . . 1.48 109.874 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 68.5 m-85 -112.35 117.03 31.34 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.57 -0.287 . . . . 2.17 110.442 -179.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.41 HG21 HD12 ' A' ' 15' ' ' LEU . 36.1 t -106.04 124.65 61.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.439 -0.346 . . . . 1.65 110.375 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -100.37 155.72 17.65 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.213 -0.449 . . . . 3.16 110.762 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.0 p -128.25 169.16 14.51 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 108.722 -0.844 . . . . 2.17 108.722 178.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 96.2 mt -71.29 -4.38 25.63 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.997 0.369 . . . . 3.05 111.997 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -101.92 11.75 38.07 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.002 0.43 . . . . 2.7 110.911 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 69.85 18.47 74.3 Favored Glycine 0 N--CA 1.451 -0.362 0 CA-C-N 115.935 -0.575 . . . . 2.64 112.786 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -95.15 127.0 40.86 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.643 0.259 . . . . 2.34 110.402 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.7 m -107.79 126.34 52.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.345 -0.389 . . . . 2.31 110.11 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.7 mt -116.48 144.76 23.39 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 116.289 -0.414 . . . . 1.83 110.432 -179.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.33 143.08 30.94 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.94 -0.393 . . . . 2.02 109.94 179.251 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.538 HD11 HG12 ' A' ' 30' ' ' ILE . 59.5 mt -138.96 143.12 38.43 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.702 0.287 . . . . 1.33 111.594 -179.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -97.32 108.79 21.59 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.987 -0.746 . . . . 2.4 108.987 178.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.523 ' O ' ' HG2' ' A' ' 1' ' ' MET . 4.6 m -135.34 168.58 22.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 116.471 -0.331 . . . . 1.25 110.749 -179.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.415 ' O ' HD12 ' A' ' 56' ' ' LEU . 61.1 mm-40 -127.69 159.46 65.99 Favored Pre-proline 0 C--N 1.319 -0.725 0 N-CA-C 109.316 -0.624 . . . . 1.85 109.316 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_exo -52.55 -35.98 69.1 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 122.79 2.326 . . . . 1.78 112.806 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.56 3.36 22.04 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.74 0.644 . . . . 1.8 112.74 -179.06 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -79.88 138.22 37.11 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.907 -0.317 . . . . 1.23 111.146 -179.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.1 OUTLIER -86.74 147.91 25.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.049 -0.523 . . . . 1.44 110.488 -179.901 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 48.5 mm -56.78 -36.48 49.51 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-O 120.872 0.367 . . . . 0.99 110.655 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -58.26 -43.44 87.88 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.9 -0.591 . . . . 2.22 109.915 178.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 64.3 t30 -70.07 -35.83 74.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.74 -0.663 . . . . 1.23 110.323 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 22' ' ' THR . 98.2 t -62.54 -44.41 99.31 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 N-CA-C 109.646 -0.501 . . . . 0.64 109.646 179.123 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -63.21 -34.67 78.15 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.176 -0.466 . . . . 1.32 110.16 179.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.86 -34.79 78.95 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.054 -0.521 . . . . 1.08 109.627 178.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -68.76 -34.99 76.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.779 -0.646 . . . . 1.08 109.857 178.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.538 HG12 HD11 ' A' ' 15' ' ' LEU . 57.5 mt -72.56 -40.85 63.4 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 108.86 -0.793 . . . . 1.31 108.86 178.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -60.57 -37.05 80.04 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.599 -0.728 . . . . 1.93 110.626 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -65.13 -30.54 71.47 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.07 -0.514 . . . . 2.05 111.751 -179.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -93.12 -49.25 6.09 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 113.074 0.768 . . . . 2.17 113.074 -178.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 51.5 mm-40 -88.45 -19.34 26.64 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 113.4 0.889 . . . . 2.14 113.4 -177.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 71.28 24.37 77.04 Favored Glycine 0 N--CA 1.453 -0.202 0 C-N-CA 120.717 -0.754 . . . . 2.01 112.57 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 77.1 mt -99.03 129.82 28.77 Favored Pre-proline 0 C--N 1.327 -0.384 0 O-C-N 122.869 -0.195 . . . . 1.83 110.642 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -52.1 136.39 53.41 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 123.028 2.485 . . . . 2.04 112.493 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -64.84 -15.22 49.2 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.971 2.448 . . . . 1.52 112.902 -179.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -78.76 -26.91 44.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.996 0.427 . . . . 2.95 110.607 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -94.77 -11.15 29.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.215 0.531 . . . . 2.56 110.084 179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 66.0 mt-30 -78.98 109.9 13.71 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.464 -0.789 . . . . 1.4 111.72 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.566 ' HB3' ' CE2' ' B' ' 427' ' ' PHE . 7.9 mmt180 -111.35 102.16 10.57 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.436 -0.579 . . . . 2.65 109.436 178.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.616 ' HB3' HD12 ' A' ' 50' ' ' LEU . 18.0 mt -88.64 135.21 33.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.157 -0.474 . . . . 1.02 111.759 -179.058 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.758 HD12 ' HB3' ' B' ' 401' ' ' LEU . 0.0 OUTLIER -129.89 150.16 34.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.846 -0.615 . . . . 2.14 110.673 179.571 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.554 ' HB2' HD21 ' A' ' 50' ' ' LEU . 29.6 t80 -133.48 96.04 3.63 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.654 -0.703 . . . . 1.71 109.144 178.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.68 39.81 20.65 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 115.795 -0.638 . . . . 2.1 111.867 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 95.23 -16.56 61.05 Favored Glycine 0 N--CA 1.453 -0.23 0 C-N-CA 120.734 -0.746 . . . . 1.84 113.153 179.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 42.4 mtmt -93.11 114.57 27.13 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 122.821 -0.223 . . . . 3.05 111.157 -179.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -68.35 136.36 53.26 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.269 -0.423 . . . . 2.3 110.365 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.616 HD12 ' HB3' ' A' ' 43' ' ' LEU . 18.6 mt -92.59 122.74 35.31 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.261 -0.427 . . . . 1.17 111.883 -178.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.7 ' HB2' ' HG2' ' A' ' 54' ' ' ARG . 30.3 mt-10 -80.13 150.02 30.36 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.1 -0.5 . . . . 2.65 110.475 179.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -65.54 -33.43 75.9 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.791 -0.64 . . . . 1.83 111.992 -178.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -85.2 17.09 34.89 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.995 -0.622 . . . . 1.82 114.353 -178.519 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.7 ' HG2' ' HB2' ' A' ' 51' ' ' GLU . 20.3 mmt180 -117.11 165.24 13.62 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 117.285 0.542 . . . . 2.69 110.868 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 22' ' ' THR . 19.5 p -109.49 177.78 4.64 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.044 -0.525 . . . . 1.71 109.589 178.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.415 HD12 ' O ' ' A' ' 18' ' ' GLU . 75.9 mt -67.22 -36.68 82.2 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.836 0.35 . . . . 1.49 111.111 179.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.2 m -67.22 -21.76 65.74 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.326 -0.397 . . . . 1.94 111.561 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 44.5 m-20 -67.67 -28.34 67.61 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.544 -0.298 . . . . 2.03 111.247 -179.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -112.58 14.3 20.13 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.824 0.345 . . . . 1.76 111.058 -179.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 59.32 38.13 23.22 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.723 -0.672 . . . . 2.96 111.455 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 73.7 mt -84.39 107.76 15.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 116.015 -0.539 . . . . 1.65 109.848 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -101.46 -167.06 1.37 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.87 -0.605 . . . . 2.66 110.58 -179.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.507 ' HB3' ' HB2' ' A' ' 1' ' ' MET . 56.3 pttt -72.4 144.5 48.16 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.693 0.282 . . . . 3.22 111.261 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 68.84 18.87 8.5 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.61 -0.723 . . . . 3.12 112.939 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 51.5 m -76.58 154.74 34.18 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.74 -0.467 . . . . 1.83 109.74 178.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 9.4 m -105.76 119.55 39.44 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.934 0.397 . . . . 2.03 111.099 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.4 mp -111.34 148.98 31.81 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.671 -0.695 . . . . 1.41 109.193 179.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 78.4 m80 -116.1 137.56 52.02 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 120.721 0.296 . . . . 2.76 111.188 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 33.4 tp -116.16 115.01 25.25 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.158 -0.474 . . . . 1.54 111.329 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.533 HG23 HD11 ' A' ' 44' ' ' ILE . 39.7 t -105.24 132.58 51.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.995 -0.548 . . . . 1.79 110.091 179.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 78.3 mt -91.26 109.55 20.82 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.448 -0.575 . . . . 2.43 109.448 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.545 ' HG3' ' HA ' ' B' ' 424' ' ' SER . 23.3 ttt180 -92.06 117.69 30.08 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.142 0.496 . . . . 3.19 111.159 -179.702 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.8 mt -89.01 155.89 19.2 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.689 -0.687 . . . . 2.99 110.3 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 74' ' ' ARG . 14.1 mmt180 -92.48 -7.12 48.32 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.27 0.557 . . . . 3.67 109.979 179.063 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -166.64 166.08 38.78 Favored Glycine 0 N--CA 1.442 -0.904 0 N-CA-C 110.626 -0.99 . . . . 3.08 110.626 179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.996 0 CA-C-O 118.154 -1.359 . . . . 3.82 111.24 -179.95 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.773 0 N-CA-C 111.963 -0.455 . . . . 5.66 111.963 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 3.6 m -85.1 64.82 8.9 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.209 0.528 . . . . 5.53 110.744 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -80.69 74.54 7.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.931 -0.577 . . . . 3.98 111.106 -179.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.18 -7.37 57.0 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.13 0.491 . . . . 4.15 110.353 179.251 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 390' ' ' PHE . . . . . 0.719 ' HB2' HD11 ' B' ' 395' ' ' ILE . 0.1 OUTLIER -129.09 97.48 26.11 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 115.993 -0.548 . . . . 2.51 110.481 -179.677 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -64.83 147.63 89.59 Favored 'Trans proline' 0 C--O 1.235 0.361 0 C-N-CA 122.645 2.23 . . . . 3.77 111.349 179.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -49.86 -59.23 4.04 Favored 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 113.588 0.959 . . . . 5.36 113.588 -178.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -48.91 -52.41 24.7 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.554 0.575 . . . . 6.89 112.554 -179.031 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . 0.431 HG22 ' HB2' ' B' ' 419' ' ' ALA . 0.0 OUTLIER -56.09 -43.11 77.74 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.348 -0.387 . . . . 4.2 111.759 -179.467 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 395' ' ' ILE . . . . . 0.719 HD11 ' HB2' ' B' ' 390' ' ' PHE . 75.0 mt -66.16 -51.82 55.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.412 -0.358 . . . . 3.8 110.399 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -57.78 -40.38 79.7 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.961 -0.563 . . . . 6.27 112.099 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 397' ' ' GLN . . . . . 0.438 ' O ' ' HG ' ' B' ' 401' ' ' LEU . 28.1 mm-40 -63.72 -43.52 96.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.932 0.396 . . . . 6.91 110.703 179.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 398' ' ' LEU . . . . . 0.518 HD13 HG23 ' B' ' 408' ' ' VAL . 1.0 OUTLIER -73.98 -33.9 64.02 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.95 -0.568 . . . . 4.31 111.801 -179.462 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 399' ' ' MET . . . . . 0.47 ' HE1' ' HB ' ' B' ' 408' ' ' VAL . 30.3 mmt -67.12 -40.94 86.9 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.821 0.343 . . . . 5.8 111.269 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -63.76 -24.52 67.8 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.12 -0.491 . . . . 7.71 112.119 -178.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 401' ' ' LEU . . . . . 0.758 ' HB3' HD12 ' A' ' 44' ' ' ILE . 31.9 mt -63.29 -23.28 67.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.026 0.441 . . . . 5.69 110.879 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 109.78 42.23 1.24 Allowed Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 121.039 -0.6 . . . . 5.87 111.614 -179.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -129.49 153.46 80.65 Favored Pre-proline 0 C--N 1.325 -0.464 0 N-CA-C 110.527 -0.175 . . . . 4.83 110.527 -179.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -83.82 160.07 14.05 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 122.724 2.283 . . . . 4.72 112.612 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.462 ' O ' HG12 ' B' ' 408' ' ' VAL . 23.7 ttt180 -61.04 -30.83 70.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.579 -0.737 . . . . 4.16 110.379 179.512 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -56.68 -43.91 80.91 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.563 -0.744 . . . . 4.69 110.714 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -71.82 -42.09 67.42 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.707 -0.679 . . . . 2.99 112.124 -179.081 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 408' ' ' VAL . . . . . 0.518 HG23 HD13 ' B' ' 398' ' ' LEU . 4.2 p -61.61 -37.3 77.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 N-CA-C 111.989 0.366 . . . . 2.06 111.989 -179.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 71.9 t -68.94 -48.21 71.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.648 0.261 . . . . 2.89 110.79 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 82.5 mttt -61.3 -44.15 97.7 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.975 0.417 . . . . 5.05 111.167 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -66.0 -49.59 67.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.915 -0.584 . . . . 2.96 111.725 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 45.3 mt -62.49 -32.38 73.28 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.774 0.657 . . . . 3.45 112.774 -179.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 413' ' ' LYS . . . . . 0.452 ' HE2' ' CZ ' ' B' ' 390' ' ' PHE . 61.4 mmtt -69.18 -45.25 70.44 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.923 -0.311 . . . . 5.52 111.721 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 29.0 pt20 -75.28 -26.94 59.15 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.925 0.713 . . . . 5.53 112.925 -178.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 415' ' ' THR . . . . . 0.506 HG21 ' HA ' ' B' ' 422' ' ' ALA . 41.2 p -94.61 -3.28 49.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.084 0.469 . . . . 5.42 111.146 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 61.82 60.85 1.5 Allowed 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 113.563 0.949 . . . . 6.37 113.563 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 72.03 -24.16 0.7 Allowed Glycine 0 CA--C 1.522 0.5 0 N-CA-C 115.945 1.138 . . . . 4.33 115.945 177.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.37 103.09 2.32 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 122.0 0.905 . . . . 6.25 110.944 -179.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 419' ' ' ALA . . . . . 0.595 ' HA ' ' HB3' ' B' ' 422' ' ' ALA . . . -66.24 -20.66 66.18 Favored 'General case' 0 CA--C 1.516 -0.327 0 CA-C-N 115.023 -0.989 . . . . 4.12 112.69 -178.231 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -61.69 -50.33 72.9 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.481 0.658 . . . . 6.99 109.305 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -80.46 -27.11 37.96 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.546 -0.752 . . . . 7.48 109.823 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 422' ' ' ALA . . . . . 0.595 ' HB3' ' HA ' ' B' ' 419' ' ' ALA . . . -61.35 -48.09 82.88 Favored 'General case' 0 CA--C 1.519 -0.235 0 N-CA-C 110.02 -0.363 . . . . 3.68 110.02 178.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.418 ' O ' ' HB2' ' B' ' 427' ' ' PHE . . . -65.68 -40.51 92.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.854 -0.612 . . . . 3.8 109.685 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 424' ' ' SER . . . . . 0.545 ' HA ' ' HG3' ' A' ' 72' ' ' ARG . 21.6 m -61.41 -39.39 90.56 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.749 -0.659 . . . . 5.05 111.069 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.69 -46.84 23.99 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.291 -0.413 . . . . 4.36 110.979 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.3 -37.06 76.77 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.988 0.366 . . . . 3.21 111.988 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 427' ' ' PHE . . . . . 0.566 ' CE2' ' HB3' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -77.25 3.15 13.58 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 113.621 0.971 . . . . 5.27 113.621 -178.683 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -56.94 -20.98 26.54 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.251 0.463 . . . . 5.32 112.251 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 14.2 m . . . . . 0 C--O 1.251 1.134 0 CA-C-O 118.61 -0.709 . . . . 5.11 111.328 -179.777 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.456 ' HG2' ' O ' ' A' ' 17' ' ' VAL . 20.8 ptt? . . . . . 0 N--CA 1.481 1.094 0 CA-C-O 120.577 0.227 . . . . 1.65 110.423 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -109.28 138.17 46.04 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 111.967 0.358 . . . . 1.92 111.967 -179.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 16.0 pt -130.32 159.38 42.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 115.779 -0.646 . . . . 1.48 109.534 178.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -121.03 123.65 42.91 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.75 0.309 . . . . 2.17 110.574 -179.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.4 t -105.42 127.22 60.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 116.451 -0.34 . . . . 1.65 111.008 -179.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.1 mmtp -92.65 128.3 38.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.282 -0.417 . . . . 3.16 110.829 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.436 HG23 HD23 ' A' ' 69' ' ' LEU . 0.2 OUTLIER -105.06 164.76 11.56 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.224 -0.444 . . . . 2.17 110.751 179.796 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.402 ' HA ' HD23 ' A' ' 8' ' ' LEU . 10.5 mt -64.12 -15.56 59.95 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.413 0.523 . . . . 3.05 112.413 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -90.79 5.23 49.19 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.936 0.398 . . . . 2.7 110.632 179.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 81.13 3.97 90.58 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.858 -0.687 . . . . 2.64 111.416 -179.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.3 ttmt -75.11 148.41 39.72 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.413 -0.393 . . . . 2.34 111.037 -179.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.9 m -119.3 108.19 14.31 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.802 -0.814 . . . . 2.31 108.802 178.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 17.9 mt -92.49 126.51 44.98 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.33 -0.396 . . . . 1.83 111.466 -178.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -92.0 122.6 34.66 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.196 -0.668 . . . . 2.02 109.196 178.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 76.2 mt -122.25 137.94 54.66 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 112.429 0.529 . . . . 1.33 112.429 -178.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -90.78 108.5 19.87 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.259 -1.015 . . . . 2.4 108.259 178.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.456 ' O ' ' HG2' ' A' ' 1' ' ' MET . 10.9 m -139.49 173.82 10.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.048 0.451 . . . . 1.25 111.056 -178.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 36.5 mm-40 -138.93 157.31 71.8 Favored Pre-proline 0 C--N 1.32 -0.708 0 N-CA-C 107.923 -1.14 . . . . 1.85 107.923 179.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.772 ' HA ' ' HB2' ' A' ' 56' ' ' LEU . 88.2 Cg_exo -50.1 -33.04 33.73 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.749 2.299 . . . . 1.78 112.883 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.5 m -74.36 -10.17 59.32 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.799 0.666 . . . . 1.8 112.799 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -77.33 135.46 38.38 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.85 -0.426 . . . . 1.23 109.85 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -86.16 150.12 24.63 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.538 -0.301 . . . . 1.44 110.945 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.421 HG13 ' HB3' ' A' ' 50' ' ' LEU . 43.5 mm -55.66 -36.06 41.17 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-O 121.033 0.444 . . . . 0.99 110.427 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.447 ' HB2' ' HB3' ' A' ' 52' ' ' ASP . 20.4 tt0 -59.42 -41.37 89.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.581 -0.736 . . . . 2.22 110.695 179.417 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -71.6 -34.84 70.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.032 -0.531 . . . . 1.23 110.679 -179.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.8 t -60.62 -42.61 92.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.069 -0.514 . . . . 0.64 109.725 179.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.522 ' HG2' HD12 ' A' ' 43' ' ' LEU . 37.2 mtmt -62.74 -36.39 82.85 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.926 -0.579 . . . . 1.32 110.63 179.37 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.45 -35.54 80.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.985 -0.552 . . . . 1.08 110.55 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -67.74 -37.34 82.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.018 -0.537 . . . . 1.08 109.909 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 54.2 mt -70.99 -33.05 50.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.027 -0.533 . . . . 1.31 110.196 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.741 ' HG3' ' HD3' ' A' ' 38' ' ' PRO . 1.7 tt0 -64.84 -34.6 78.75 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.943 -0.571 . . . . 1.93 110.803 179.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -81.18 -36.2 30.45 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.291 -0.413 . . . . 2.05 111.157 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 75.6 mttt -76.48 -55.38 5.58 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.399 0.518 . . . . 2.17 112.399 -179.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 55.7 mm-40 -85.74 -42.29 14.35 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.118 0.414 . . . . 2.14 112.118 -178.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 105.55 8.05 35.81 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.614 -0.803 . . . . 2.01 111.361 -179.097 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 24.9 mt -89.58 121.09 69.5 Favored Pre-proline 0 C--N 1.324 -0.526 0 N-CA-C 109.73 -0.47 . . . . 1.83 109.73 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.463 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 55.1 Cg_exo -54.39 135.32 65.26 Favored 'Trans proline' 0 C--N 1.342 0.231 0 C-N-CA 122.907 2.405 . . . . 2.04 111.409 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.741 ' HD3' ' HG3' ' A' ' 31' ' ' GLN . 32.2 Cg_exo -59.23 -22.39 64.65 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 123.302 2.668 . . . . 1.52 112.373 -179.045 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -77.4 -23.21 50.7 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.928 -0.578 . . . . 2.95 110.882 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 64.7 mt-30 -102.56 7.74 40.0 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.119 0.485 . . . . 2.56 110.634 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -91.34 176.16 6.66 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.472 -0.785 . . . . 1.4 110.475 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.458 ' O ' ' HA ' ' A' ' 69' ' ' LEU . 0.0 OUTLIER -160.37 94.51 1.08 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.85 -0.796 . . . . 2.65 108.85 179.38 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.522 HD12 ' HG2' ' A' ' 27' ' ' LYS . 16.8 mt -100.18 123.19 44.12 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.094 0.473 . . . . 1.02 112.263 -178.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.667 HG22 ' HA ' ' A' ' 49' ' ' GLN . 20.0 pt -132.78 163.07 38.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.706 -0.679 . . . . 2.14 109.687 178.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.45 ' CB ' HD21 ' A' ' 50' ' ' LEU . 74.7 t80 -130.09 112.74 13.72 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.465 -0.334 . . . . 1.71 110.281 179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 59.58 35.11 22.52 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.791 -0.641 . . . . 2.1 111.98 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.3 -17.67 56.57 Favored Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.771 -0.728 . . . . 1.84 113.249 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 51.8 mtmt -95.39 126.27 40.58 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.112 -0.329 . . . . 3.05 110.112 -179.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.667 ' HA ' HG22 ' A' ' 44' ' ' ILE . 0.9 OUTLIER -67.14 151.08 48.23 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.054 0.454 . . . . 2.3 111.705 -178.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.45 HD21 ' CB ' ' A' ' 45' ' ' PHE . 18.9 mt -108.64 132.52 53.82 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.574 -0.739 . . . . 1.17 110.206 179.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.783 ' HB2' ' HG2' ' A' ' 54' ' ' ARG . 46.9 mt-10 -86.85 146.78 26.08 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.401 -0.363 . . . . 2.65 110.667 179.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.447 ' HB3' ' HB2' ' A' ' 24' ' ' GLU . 9.0 m-20 -61.76 -34.76 76.43 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 112.713 0.634 . . . . 1.83 112.713 -178.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -85.12 14.23 50.56 Favored Glycine 0 N--CA 1.453 -0.217 0 C-N-CA 120.962 -0.637 . . . . 1.82 113.043 -179.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.783 ' HG2' ' HB2' ' A' ' 51' ' ' GLU . 30.1 mmt180 -112.45 152.0 29.23 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.027 0.441 . . . . 2.69 110.456 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.501 ' HB ' ' O ' ' A' ' 19' ' ' PRO . 68.4 p -99.19 175.26 5.95 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 108.891 -0.781 . . . . 1.71 108.891 179.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.772 ' HB2' ' HA ' ' A' ' 19' ' ' PRO . 88.0 mt -68.93 -31.54 70.5 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.357 -0.608 . . . . 1.49 109.357 178.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.89 -28.53 68.4 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.555 -0.748 . . . . 1.94 110.632 178.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' A' ' 55' ' ' THR . 2.4 m-20 -60.34 -32.41 71.23 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.112 -0.495 . . . . 2.03 111.118 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -108.82 12.0 25.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.233 -0.44 . . . . 1.76 111.58 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 61.4 30.21 18.85 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.911 -0.586 . . . . 2.96 111.707 -179.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.453 ' HB ' ' HB3' ' A' ' 56' ' ' LEU . 86.4 mt -74.42 116.59 17.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 N-CA-C 109.375 -0.602 . . . . 1.65 109.375 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.4 mt-30 -109.5 -163.24 0.85 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.953 -0.567 . . . . 2.66 110.306 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.9 pttt -73.86 149.43 41.56 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.677 -0.238 . . . . 3.22 110.815 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 69.41 19.15 7.72 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.711 0.634 . . . . 3.12 112.711 179.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.417 ' HB3' ' HE1' ' A' ' 45' ' ' PHE . 20.3 m -82.3 146.76 29.26 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.784 0.326 . . . . 1.83 110.328 179.265 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 10.3 m -105.33 120.9 42.72 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.045 0.45 . . . . 2.03 111.539 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.5 mp -102.62 147.27 27.0 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.7 -0.682 . . . . 1.41 109.461 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.57 ' HB2' ' CG1' ' A' ' 44' ' ' ILE . 23.9 m80 -105.57 129.78 53.76 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.579 -0.282 . . . . 2.76 110.936 -179.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.458 ' HA ' ' O ' ' A' ' 42' ' ' ARG . 29.1 tp -123.4 121.86 36.82 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.254 -0.43 . . . . 1.54 110.781 -179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.651 HG22 ' HB1' ' B' ' 423' ' ' ALA . 0.5 OUTLIER -116.88 153.41 18.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.311 -0.404 . . . . 1.79 110.917 179.612 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 95.9 mt -85.89 131.23 34.34 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.077 0.465 . . . . 2.43 111.203 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.561 ' HA ' ' HB3' ' B' ' 424' ' ' SER . 12.1 ttt180 -106.16 80.01 1.46 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.858 -0.61 . . . . 3.19 109.501 178.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.622 HD11 ' HB3' ' B' ' 420' ' ' GLU . 77.6 mt -63.18 150.06 43.86 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.726 -0.67 . . . . 2.99 111.417 -179.503 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 74' ' ' ARG . 14.5 mmt85 -103.36 -63.25 1.2 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.072 -0.513 . . . . 3.67 110.087 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -114.77 146.35 18.77 Favored Glycine 0 N--CA 1.445 -0.746 0 N-CA-C 111.107 -0.797 . . . . 3.08 111.107 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.152 0 CA-C-O 118.754 -1.026 . . . . 3.82 111.869 -179.701 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.654 0 N-CA-C 111.271 -0.732 . . . . 5.66 111.271 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 1.9 m -71.76 94.66 1.41 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.063 0.458 . . . . 5.53 110.147 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -118.89 32.81 5.94 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.884 -0.598 . . . . 3.98 110.635 -179.164 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.12 -25.27 68.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.631 -0.713 . . . . 4.15 110.607 179.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 390' ' ' PHE . . . . . 0.768 ' HB3' HD11 ' B' ' 395' ' ' ILE . 57.4 m-85 -109.92 113.42 57.25 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-N 115.754 -0.657 . . . . 2.51 110.228 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 10.8 Cg_exo -72.67 121.09 7.1 Favored 'Trans proline' 0 C--O 1.235 0.347 0 C-N-CA 123.054 2.503 . . . . 3.77 111.968 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 392' ' ' GLU . . . . . 0.634 ' HB3' ' HE3' ' B' ' 396' ' ' LYS . 18.4 mt-10 -51.19 -50.34 59.2 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.873 -0.603 . . . . 5.36 112.514 -179.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 393' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -55.16 -50.12 70.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.025 -0.534 . . . . 6.89 111.918 -179.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 2.1 m -61.18 -45.18 95.67 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.032 -0.531 . . . . 4.2 111.29 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 395' ' ' ILE . . . . . 0.768 HD11 ' HB3' ' B' ' 390' ' ' PHE . 75.0 mt -60.64 -48.71 87.48 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.109 0 CA-C-O 120.662 0.268 . . . . 3.8 110.848 179.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 396' ' ' LYS . . . . . 0.634 ' HE3' ' HB3' ' B' ' 392' ' ' GLU . 73.3 mttt -58.28 -41.27 84.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 6.27 111.925 -179.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -68.33 -36.8 79.81 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.841 0.353 . . . . 6.91 110.723 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 83.4 mt -68.43 -24.28 64.72 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.285 -0.416 . . . . 4.31 111.051 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 399' ' ' MET . . . . . 0.615 ' HG2' ' O ' ' B' ' 395' ' ' ILE . 23.1 mmt -68.36 -25.11 64.92 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.04 0.448 . . . . 5.8 110.63 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -73.96 -11.43 60.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.886 -0.597 . . . . 7.71 111.416 -179.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 74.9 mt -86.03 16.96 3.79 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.035 0.383 . . . . 5.69 112.035 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 62.53 47.3 90.36 Favored Glycine 0 CA--C 1.518 0.227 0 C-N-CA 121.07 -0.586 . . . . 5.87 112.589 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -134.51 150.3 73.36 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-O 120.361 0.124 . . . . 4.83 110.802 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 404' ' ' PRO . . . . . 0.466 ' HG2' ' HB2' ' B' ' 407' ' ' ALA . 52.4 Cg_endo -69.49 153.35 70.29 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.955 2.437 . . . . 4.72 112.204 179.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.467 ' HA ' ' HE3' ' B' ' 399' ' ' MET . 25.9 ttt180 -68.76 -41.0 79.47 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.123 0.416 . . . . 4.16 112.123 -178.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -59.6 -37.31 78.24 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.405 -0.361 . . . . 4.69 111.527 -179.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 407' ' ' ALA . . . . . 0.466 ' HB2' ' HG2' ' B' ' 404' ' ' PRO . . . -61.72 -39.38 91.3 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.244 -0.434 . . . . 2.99 110.518 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 55.2 t -66.09 -40.75 88.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.85 -0.614 . . . . 2.06 110.11 179.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 88.6 t -60.24 -46.01 95.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.033 -0.531 . . . . 2.89 110.189 179.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 19.2 mttp -67.69 -39.3 84.46 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.984 -0.553 . . . . 5.05 111.155 179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -65.81 -49.2 69.12 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.181 -0.463 . . . . 2.96 111.309 179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 46.5 mt -63.63 -30.7 71.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.452 -0.34 . . . . 3.45 111.375 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -64.66 -49.06 72.48 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.32 -0.4 . . . . 5.52 111.041 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -80.05 -9.73 59.72 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.207 0.817 . . . . 5.53 113.207 -178.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 415' ' ' THR . . . . . . . . . . . . . 31.4 p -107.75 -4.99 17.59 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.759 0.314 . . . . 5.42 110.96 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 55.1 m-80 64.91 55.4 1.19 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.857 -0.611 . . . . 6.37 112.501 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 72.71 -6.94 10.05 Favored Glycine 0 CA--C 1.519 0.287 0 CA-C-N 115.864 -0.607 . . . . 4.33 114.253 178.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 34.1 t-20 -67.8 93.99 0.43 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.018 0.437 . . . . 6.25 110.15 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -59.08 -35.88 74.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.527 -0.76 . . . . 4.12 112.287 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 420' ' ' GLU . . . . . 0.622 ' HB3' HD11 ' A' ' 73' ' ' LEU . 12.7 mt-10 -71.94 -43.79 64.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.883 0.373 . . . . 6.99 110.674 -179.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -67.78 -39.68 84.04 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.189 -0.46 . . . . 7.48 109.861 179.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -61.73 -38.99 89.99 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.779 -0.646 . . . . 3.68 110.436 179.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.651 ' HB1' HG22 ' A' ' 70' ' ' VAL . . . -57.3 -48.8 77.99 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 116.009 -0.541 . . . . 3.8 110.613 179.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 424' ' ' SER . . . . . 0.561 ' HB3' ' HA ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -63.12 -30.88 71.94 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.053 -0.521 . . . . 5.05 111.612 179.123 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 425' ' ' LEU . . . . . 0.598 ' O ' ' HG2' ' B' ' 428' ' ' GLN . 3.4 mm? -81.82 -50.25 9.44 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 113.747 1.017 . . . . 4.36 113.747 -178.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.3 pp -62.63 -34.25 76.66 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.126 0.788 . . . . 3.21 113.126 -178.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 427' ' ' PHE . . . . . 0.442 ' HD2' ' HG2' ' A' ' 42' ' ' ARG . 2.0 m-85 -67.04 -13.03 61.52 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.341 0.867 . . . . 5.27 113.341 -179.467 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 428' ' ' GLN . . . . . 0.598 ' HG2' ' O ' ' B' ' 425' ' ' LEU . 0.0 OUTLIER -77.39 -18.63 57.15 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 120.809 -0.356 . . . . 5.32 111.811 -179.779 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 6.6 m . . . . . 0 C--O 1.247 0.954 0 CA-C-O 118.676 -0.678 . . . . 5.11 110.9 -179.372 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.5 ' HB2' ' HB3' ' A' ' 63' ' ' LYS . 26.0 ptt? . . . . . 0 N--CA 1.481 1.099 0 N-CA-C 110.204 -0.295 . . . . 1.65 110.204 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.858 HE22 ' HG2' ' A' ' 16' ' ' GLU . 89.2 mm-40 -102.27 135.33 44.06 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.914 0.388 . . . . 1.92 111.582 -179.42 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.3 pt -126.63 151.93 33.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.027 -0.533 . . . . 1.48 109.916 178.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -108.93 124.75 51.16 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.673 -0.239 . . . . 2.17 111.167 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.1 t -111.8 118.83 58.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 109.42 -0.585 . . . . 1.65 109.42 179.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -102.09 132.68 47.81 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.0 0.429 . . . . 3.16 111.727 -179.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.404 ' OG1' ' HB3' ' A' ' 11' ' ' LYS . 26.5 p -99.06 175.85 5.77 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.959 -0.564 . . . . 2.17 110.224 179.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.476 HD21 HG22 ' A' ' 70' ' ' VAL . 92.8 mt -79.28 10.61 3.52 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.914 0.388 . . . . 3.05 111.7 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -110.04 3.52 20.43 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.318 -0.401 . . . . 2.7 110.71 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 80.18 24.88 58.62 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.796 -0.716 . . . . 2.64 111.783 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.662 ' HE2' HG12 ' A' ' 13' ' ' ILE . 81.5 tttt -106.35 134.88 48.79 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.584 0.23 . . . . 2.34 110.499 -179.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.1 m -115.64 109.48 17.81 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.961 0.41 . . . . 2.31 110.755 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.662 HG12 ' HE2' ' A' ' 11' ' ' LYS . 7.5 mt -95.26 138.48 20.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.893 -0.594 . . . . 1.83 110.428 -179.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 1.5 m -101.94 115.09 29.78 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.761 -0.459 . . . . 2.02 109.761 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.434 HD11 HG12 ' A' ' 30' ' ' ILE . 55.1 mt -105.07 143.32 33.41 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.059 0.456 . . . . 1.33 112.124 -179.078 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.858 ' HG2' HE22 ' A' ' 2' ' ' GLN . 14.9 mt-10 -98.97 101.51 12.93 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.46 -0.791 . . . . 2.4 109.609 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 16.3 m -138.2 -179.0 2.25 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.991 -0.549 . . . . 1.25 110.821 -178.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.418 ' O ' ' HB2' ' A' ' 21' ' ' ASP . 27.4 mm-40 -132.78 157.72 77.62 Favored Pre-proline 0 C--N 1.323 -0.584 0 N-CA-C 109.035 -0.728 . . . . 1.85 109.035 179.098 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.583 ' HA ' ' HB2' ' A' ' 56' ' ' LEU . 74.6 Cg_exo -53.34 -29.67 48.95 Favored 'Trans proline' 0 CA--C 1.533 0.467 0 C-N-CA 122.882 2.388 . . . . 1.78 113.058 -179.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -76.98 -5.48 48.8 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.14 0.422 . . . . 1.8 112.14 -179.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.418 ' HB2' ' O ' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -74.07 144.04 45.18 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.029 0.442 . . . . 1.23 110.757 -179.693 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -93.48 145.13 24.73 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.798 -0.637 . . . . 1.44 110.075 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.559 HG23 HD12 ' A' ' 43' ' ' LEU . 46.1 mm -53.34 -42.77 49.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 O-C-N 123.166 0.291 . . . . 0.99 111.469 -179.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 -56.59 -44.34 80.99 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.366 -0.379 . . . . 2.22 110.7 179.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.483 ' O ' ' HG3' ' A' ' 29' ' ' LYS . 66.5 t30 -67.27 -37.31 83.26 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.961 -0.563 . . . . 1.23 110.667 -179.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 87.2 t -61.37 -43.49 96.75 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.086 -0.506 . . . . 0.64 110.462 179.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.8 mtmt -63.33 -34.17 77.12 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.209 -0.451 . . . . 1.32 110.976 179.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -64.96 -32.81 74.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.086 -0.506 . . . . 1.08 110.132 179.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.483 ' HG3' ' O ' ' A' ' 25' ' ' ASN . 21.4 mttt -71.04 -37.43 72.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.009 -0.542 . . . . 1.08 109.827 179.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.434 HG12 HD11 ' A' ' 15' ' ' LEU . 59.3 mt -66.77 -38.23 81.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 109.084 -0.71 . . . . 1.31 109.084 178.826 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -65.63 -37.34 86.3 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.753 -0.658 . . . . 1.93 110.596 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -67.72 -37.17 81.86 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.219 -0.446 . . . . 2.05 112.019 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -87.3 -54.48 4.28 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 113.046 0.758 . . . . 2.17 113.046 -178.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -77.36 -35.85 54.16 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.702 0.63 . . . . 2.14 112.702 -178.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 91.57 13.77 57.83 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.454 -0.879 . . . . 2.01 111.835 -179.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 69.0 mt -95.17 123.77 56.01 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 110.075 -0.343 . . . . 1.83 110.075 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -52.98 137.81 61.84 Favored 'Trans proline' 0 CA--C 1.532 0.378 0 C-N-CA 123.083 2.522 . . . . 2.04 112.33 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -62.57 -18.7 64.99 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.943 2.429 . . . . 1.52 111.974 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -71.13 -25.4 62.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.953 -0.567 . . . . 2.95 110.238 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -102.15 6.65 40.91 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.043 -0.526 . . . . 2.56 110.368 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.507 ' HB3' HD11 ' A' ' 69' ' ' LEU . 75.5 mt-30 -98.6 114.95 27.61 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.924 -0.58 . . . . 1.4 111.661 -179.152 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.418 ' HD2' ' HB2' ' A' ' 72' ' ' ARG . 66.6 mtp180 -116.59 101.59 8.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.241 -0.436 . . . . 2.65 109.979 178.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.559 HD12 HG23 ' A' ' 23' ' ' ILE . 21.7 mt -77.33 128.26 33.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.894 0.378 . . . . 1.02 111.26 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.436 HD13 ' HZ ' ' B' ' 403' ' ' PHE . 53.5 mt -124.88 137.63 56.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-N 115.669 -0.696 . . . . 2.14 110.772 -179.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.48 ' HB3' HD21 ' A' ' 50' ' ' LEU . 40.4 t80 -132.7 113.22 12.73 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.038 -0.727 . . . . 1.71 109.038 178.517 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 63.16 30.36 16.01 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.22 -0.446 . . . . 2.1 112.01 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 86.04 4.06 84.7 Favored Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.871 -0.681 . . . . 1.84 113.089 179.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 41.6 mtmt -116.49 136.75 52.72 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.766 0.283 . . . . 3.05 110.906 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.571 ' HB2' ' CZ ' ' B' ' 427' ' ' PHE . 8.1 tt0 -73.6 145.87 45.1 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.199 -0.455 . . . . 2.3 110.529 179.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.48 HD21 ' HB3' ' A' ' 45' ' ' PHE . 26.1 mt -105.33 140.4 38.52 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.297 -0.41 . . . . 1.17 110.594 179.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.59 ' HB2' ' CG ' ' A' ' 54' ' ' ARG . 43.5 mt-10 -80.47 138.41 36.57 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.715 -0.476 . . . . 2.65 109.715 179.199 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.457 ' HA ' ' HB ' ' A' ' 23' ' ' ILE . 71.0 m-20 -64.77 -28.37 69.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.948 0.404 . . . . 1.83 111.06 -179.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -86.37 22.85 11.23 Favored Glycine 0 N--CA 1.449 -0.434 0 CA-C-N 115.82 -0.627 . . . . 1.82 112.808 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.59 ' CG ' ' HB2' ' A' ' 51' ' ' GLU . 37.0 mmt180 -120.86 160.83 22.62 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.911 -0.403 . . . . 2.69 109.911 179.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.517 ' O ' ' HB2' ' A' ' 58' ' ' ASP . 35.2 p -103.8 174.44 5.87 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.922 -0.399 . . . . 1.71 109.922 179.287 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.583 ' HB2' ' HA ' ' A' ' 19' ' ' PRO . 85.8 mt -66.86 -35.99 81.31 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.168 0.508 . . . . 1.49 110.346 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 1.4 m -65.88 -21.85 66.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.828 -0.624 . . . . 1.94 110.339 178.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.517 ' HB2' ' O ' ' A' ' 55' ' ' THR . 4.7 m-20 -68.14 -21.51 64.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.784 -0.644 . . . . 2.03 112.158 -179.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -120.98 16.48 11.7 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.705 0.288 . . . . 1.76 111.271 -179.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 60.99 28.71 18.49 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.729 -0.669 . . . . 2.96 111.617 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 67.2 mt -78.76 114.53 19.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.212 -0.449 . . . . 1.65 110.658 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -107.92 -165.99 1.1 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.753 -0.658 . . . . 2.66 110.117 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.709 ' HD2' ' HG3' ' A' ' 64' ' ' GLU . 0.1 OUTLIER -73.77 152.57 40.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.695 -0.23 . . . . 3.22 110.985 -179.905 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.709 ' HG3' ' HD2' ' A' ' 63' ' ' LYS . 46.6 mt-10 73.16 1.7 4.1 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 112.688 0.625 . . . . 3.12 112.688 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.0 m -74.06 146.24 43.83 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.755 0.312 . . . . 1.83 110.963 179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 5.0 m -108.93 129.13 55.42 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.814 0.34 . . . . 2.03 111.192 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 6.2 mp -115.97 152.44 33.49 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.81 -0.811 . . . . 1.41 108.81 179.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . . . . . . . . . 70.5 m80 -111.04 150.54 29.19 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.645 0.259 . . . . 2.76 111.193 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.507 HD11 ' HB3' ' A' ' 41' ' ' GLN . 23.2 tp -129.84 109.79 11.21 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.314 -0.403 . . . . 1.54 111.245 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.476 HG22 HD21 ' A' ' 8' ' ' LEU . 16.0 t -96.18 126.87 48.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 109.901 -0.407 . . . . 1.79 109.901 179.016 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 63.9 mt -74.46 112.34 10.54 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.947 -0.57 . . . . 2.43 109.903 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.432 ' HA ' ' OG ' ' B' ' 424' ' ' SER . 29.3 ttt180 -85.37 103.25 14.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.119 -0.491 . . . . 3.19 111.236 -179.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 77.9 mt -73.77 126.25 29.95 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.007 -0.542 . . . . 2.99 109.796 179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 74' ' ' ARG . 11.3 mmt180 -89.39 -32.25 17.37 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.89 0.376 . . . . 3.67 111.398 -179.23 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -134.06 131.95 6.2 Favored Glycine 0 N--CA 1.446 -0.691 0 C-N-CA 120.886 -0.673 . . . . 3.08 112.028 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.706 0 CA-C-O 118.848 -0.973 . . . . 3.82 111.532 179.84 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.67 0 N-CA-C 111.495 -0.642 . . . . 5.66 111.495 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 4.2 m -77.76 70.5 4.14 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.437 0.637 . . . . 5.53 110.715 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -86.34 85.73 7.33 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.709 -0.678 . . . . 3.98 110.272 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 5.4 m -63.04 -40.54 98.04 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.706 -0.679 . . . . 4.15 111.193 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 390' ' ' PHE . . . . . 0.619 ' HB3' ' HG ' ' B' ' 412' ' ' LEU . 0.1 OUTLIER -109.27 108.35 60.18 Favored Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 115.93 -0.577 . . . . 2.51 110.884 -179.354 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 391' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -64.77 141.56 72.5 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.656 2.237 . . . . 3.77 111.137 179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 392' ' ' GLU . . . . . 0.61 ' O ' ' HG2' ' B' ' 396' ' ' LYS . 2.9 mm-40 -53.96 -41.08 67.41 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.605 0.594 . . . . 5.36 112.605 -179.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 393' ' ' GLN . . . . . 0.423 HE21 ' HB3' ' B' ' 393' ' ' GLN . 5.6 tt0 -55.37 -52.58 63.07 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.932 0.396 . . . . 6.89 111.72 -179.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.44 -36.67 83.15 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.195 -0.457 . . . . 4.2 110.974 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 395' ' ' ILE . . . . . 0.45 ' O ' ' HG2' ' B' ' 399' ' ' MET . 93.1 mt -63.17 -42.37 96.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.075 -0.512 . . . . 3.8 110.317 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 396' ' ' LYS . . . . . 0.61 ' HG2' ' O ' ' B' ' 392' ' ' GLU . 24.1 mmtp -58.61 -41.2 85.31 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.481 -0.327 . . . . 6.27 110.913 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -63.48 -41.71 98.57 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.151 -0.477 . . . . 6.91 110.794 179.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 77.8 mt -73.44 -27.92 61.68 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.056 -0.52 . . . . 4.31 111.646 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 399' ' ' MET . . . . . 0.45 ' HG2' ' O ' ' B' ' 395' ' ' ILE . 31.4 mmt -67.62 -41.9 83.22 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.425 -0.352 . . . . 5.8 111.17 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 24.2 t0 -61.51 -24.39 66.57 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.118 -0.492 . . . . 7.71 111.699 -179.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 401' ' ' LEU . . . . . . . . . . . . . 44.9 mt -68.93 -17.5 63.96 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.164 -0.471 . . . . 5.69 111.0 179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 90.93 34.66 7.56 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.719 -0.753 . . . . 5.87 112.36 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 403' ' ' PHE . . . . . 0.436 ' HZ ' HD13 ' A' ' 44' ' ' ILE . 21.2 m-85 -113.8 149.88 42.5 Favored Pre-proline 0 C--N 1.325 -0.47 0 N-CA-C 110.531 -0.174 . . . . 4.83 110.531 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -67.03 142.62 62.46 Favored 'Trans proline' 0 CA--C 1.531 0.329 0 C-N-CA 122.474 2.116 . . . . 4.72 111.9 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -65.35 -33.81 76.83 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.394 -0.366 . . . . 4.16 111.447 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -62.56 -38.69 91.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.266 -0.424 . . . . 4.69 110.764 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -65.34 -33.94 77.14 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.163 0.506 . . . . 2.99 109.678 179.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 54.0 t -63.99 -41.73 93.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.347 -0.842 . . . . 2.06 109.432 179.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 409' ' ' VAL . . . . . 0.477 HG13 ' CZ ' ' B' ' 390' ' ' PHE . 88.0 t -59.93 -47.57 91.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.916 -0.584 . . . . 2.89 110.276 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 34.3 mttp -60.3 -47.5 85.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.663 -0.698 . . . . 5.05 111.079 179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -67.18 -44.91 78.5 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.746 -0.661 . . . . 2.96 111.96 -178.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.619 ' HG ' ' HB3' ' B' ' 390' ' ' PHE . 2.6 mm? -63.93 -31.26 72.39 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.94 0.348 . . . . 3.45 111.94 -179.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 413' ' ' LYS . . . . . 0.413 ' HA ' ' HD3' ' B' ' 413' ' ' LYS . 32.3 mmtt -71.58 -45.91 60.85 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 111.801 0.297 . . . . 5.52 111.801 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -72.05 -27.82 62.94 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.196 0.443 . . . . 5.53 112.196 -179.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 415' ' ' THR . . . . . 0.778 ' HB ' ' HB2' ' B' ' 418' ' ' ASN . 39.5 p -92.4 -14.48 28.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.816 0.341 . . . . 5.42 111.238 -179.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 59.81 62.42 1.69 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 113.039 0.755 . . . . 6.37 113.039 179.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 86.33 -12.21 61.25 Favored Glycine 0 CA--C 1.518 0.248 0 C-N-CA 120.523 -0.846 . . . . 4.33 114.051 178.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 418' ' ' ASN . . . . . 0.778 ' HB2' ' HB ' ' B' ' 415' ' ' THR . 33.4 m-80 -73.43 79.76 1.4 Allowed 'General case' 0 C--N 1.321 -0.668 0 O-C-N 122.348 -0.501 . . . . 6.25 110.117 179.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -58.62 -42.32 87.95 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.155 -0.475 . . . . 4.12 112.135 -179.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -65.11 -37.71 88.33 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.295 0.569 . . . . 6.99 110.542 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 421' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -73.34 -38.16 65.86 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.659 -0.7 . . . . 7.48 109.163 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 422' ' ' ALA . . . . . . . . . . . . . . . -61.88 -42.65 99.31 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.549 -0.751 . . . . 3.68 110.408 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -58.93 -42.11 88.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.129 0.49 . . . . 3.8 110.09 179.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 424' ' ' SER . . . . . 0.432 ' OG ' ' HA ' ' A' ' 72' ' ' ARG . 71.6 m -70.49 -37.86 74.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.85 -0.614 . . . . 5.05 110.867 179.15 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -71.38 -48.85 47.44 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 113.058 0.762 . . . . 4.36 113.058 -179.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 3.6 pp -67.3 -34.51 77.52 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.154 0.427 . . . . 3.21 112.154 -178.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 427' ' ' PHE . . . . . 0.571 ' CZ ' ' HB2' ' A' ' 49' ' ' GLN . 3.4 t80 -89.08 1.62 55.31 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 112.216 0.45 . . . . 5.27 112.216 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -59.9 -19.67 52.9 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.842 0.353 . . . . 5.32 111.698 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 41.0 m . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.244 -0.884 . . . . 5.11 109.981 179.237 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.403 ' HB2' ' HB3' ' A' ' 63' ' ' LYS . 25.0 ptt? . . . . . 0 N--CA 1.483 1.183 0 N-CA-C 110.092 -0.336 . . . . 1.65 110.092 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 77.1 mm-40 -107.42 138.68 43.18 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.659 0.266 . . . . 1.92 110.71 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 32.3 pt -124.15 163.64 23.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.439 -0.346 . . . . 1.48 110.092 179.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -117.65 122.79 44.52 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.787 0.327 . . . . 2.17 110.914 -179.593 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 56.1 t -106.74 122.39 60.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 116.287 -0.415 . . . . 1.65 109.988 179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 82.3 mttt -109.52 137.33 47.52 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.197 0.523 . . . . 3.16 111.395 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.27 159.08 16.91 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.675 -0.693 . . . . 2.17 109.554 179.298 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.471 HD21 HD11 ' B' ' 401' ' ' LEU . 55.8 mt -64.57 -6.84 8.4 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.112 0.412 . . . . 3.05 112.112 -179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.9 p -88.96 -10.52 47.43 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.058 0.456 . . . . 2.7 110.338 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 103.47 -9.02 52.78 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.97 -0.559 . . . . 2.64 112.19 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -68.18 143.6 55.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.873 0.368 . . . . 2.34 111.514 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.7 m -136.3 111.6 9.11 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.457 -0.571 . . . . 2.31 109.457 179.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.5 mt -112.43 148.69 15.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.534 -0.303 . . . . 1.83 110.717 -178.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 7.9 m -96.83 142.41 28.86 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.298 -0.63 . . . . 2.02 109.298 178.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 17.9 mt -133.41 131.19 39.68 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.843 0.354 . . . . 1.33 111.464 179.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -85.99 109.45 18.79 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.786 -0.643 . . . . 2.4 109.316 178.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.719 HG12 ' HE3' ' A' ' 29' ' ' LYS . 16.8 m -134.0 -169.8 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.93 -0.577 . . . . 1.25 110.732 -179.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.441 ' O ' HD12 ' A' ' 56' ' ' LEU . 11.7 mm-40 -153.26 153.96 30.11 Favored Pre-proline 0 C--N 1.322 -0.621 0 N-CA-C 107.408 -1.33 . . . . 1.85 107.408 178.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_exo -53.64 -31.67 61.19 Favored 'Trans proline' 0 CA--C 1.528 0.199 0 C-N-CA 122.208 1.939 . . . . 1.78 112.122 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.5 1.42 22.41 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.046 0.758 . . . . 1.8 113.046 -179.055 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -89.0 137.79 31.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.83 0.347 . . . . 1.23 110.161 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.0 OUTLIER -83.07 154.2 24.51 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.247 -0.433 . . . . 1.44 111.084 -179.467 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 34.3 mm -56.3 -41.32 70.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.369 -0.378 . . . . 0.99 110.9 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -57.45 -37.47 72.9 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.108 -0.496 . . . . 2.22 110.677 179.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -67.81 -32.5 73.1 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.076 -0.511 . . . . 1.23 110.435 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.549 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 46.2 t -69.28 -40.68 80.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 108.91 -0.774 . . . . 0.64 108.91 178.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.566 ' HE3' ' HB2' ' A' ' 41' ' ' GLN . 6.7 mmmm -59.03 -43.28 91.6 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.527 -0.761 . . . . 1.32 109.871 179.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -61.01 -41.44 96.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.485 -0.78 . . . . 1.08 110.7 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.719 ' HE3' HG12 ' A' ' 17' ' ' VAL . 28.4 mtmm -65.11 -36.84 85.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.008 -0.542 . . . . 1.08 110.944 179.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.408 HG13 ' O ' ' A' ' 26' ' ' VAL . 81.7 mt -66.48 -38.06 80.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 109.973 -0.38 . . . . 1.31 109.973 178.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -68.7 -31.8 71.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.036 0.446 . . . . 1.93 110.481 179.57 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -74.64 -22.98 58.61 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.843 0.354 . . . . 2.05 111.28 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 76.2 mttt -97.45 -43.52 7.24 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 112.216 0.45 . . . . 2.17 112.216 -179.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 53.7 mm-40 -98.12 -31.27 12.2 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 113.131 0.789 . . . . 2.14 113.131 -178.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 91.75 5.47 66.52 Favored Glycine 0 C--N 1.324 -0.134 0 C-N-CA 120.533 -0.841 . . . . 2.01 112.152 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 65.7 mt -84.96 125.09 71.52 Favored Pre-proline 0 C--N 1.328 -0.362 0 N-CA-C 110.395 -0.224 . . . . 1.83 110.395 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_exo -55.09 140.93 80.55 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.875 2.383 . . . . 2.04 111.737 179.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -64.1 -13.0 35.15 Favored 'Trans proline' 0 C--N 1.343 0.275 0 C-N-CA 122.873 2.382 . . . . 1.52 112.432 -179.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -76.58 -23.93 53.49 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.031 -0.531 . . . . 2.95 110.098 179.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.457 ' HA ' ' HB3' ' A' ' 72' ' ' ARG . 83.4 mt-30 -100.16 -15.93 17.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.85 -0.614 . . . . 2.56 110.555 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.566 ' HB2' ' HE3' ' A' ' 27' ' ' LYS . 79.8 mt-30 -75.84 125.05 28.35 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.96 -0.564 . . . . 1.4 111.197 -179.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 57.2 mtt180 -128.62 103.46 7.11 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.205 -0.452 . . . . 2.65 109.921 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.455 ' HB3' HD12 ' A' ' 50' ' ' LEU . 80.8 mt -90.06 132.11 35.57 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.343 0.498 . . . . 1.02 112.343 -178.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.501 HG12 ' CE1' ' B' ' 427' ' ' PHE . 1.1 mt -120.93 141.83 39.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.646 -0.706 . . . . 2.14 109.418 179.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.542 ' HB2' HD11 ' A' ' 50' ' ' LEU . 50.0 t80 -128.7 102.72 6.7 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.461 -0.336 . . . . 1.71 110.279 179.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 63.23 12.53 6.2 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.825 -0.625 . . . . 2.1 112.629 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 111.15 -6.88 28.9 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.863 -0.684 . . . . 1.84 112.09 -179.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 82.8 mttt -91.42 137.29 32.48 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.297 -0.26 . . . . 3.05 110.297 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -76.26 123.21 25.55 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 123.432 0.457 . . . . 2.3 110.244 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.542 HD11 ' HB2' ' A' ' 45' ' ' PHE . 42.8 mt -92.6 122.87 35.45 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.229 -0.441 . . . . 1.17 110.864 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -93.11 145.43 24.41 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.025 -0.534 . . . . 2.65 110.205 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -58.07 -42.12 84.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.186 -0.461 . . . . 1.83 112.197 -179.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -80.86 41.49 2.59 Favored Glycine 0 CA--C 1.519 0.33 0 C-N-CA 121.339 -0.458 . . . . 1.82 114.201 -178.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 20.3 mmt180 -134.58 158.78 43.12 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.263 -0.643 . . . . 2.69 109.263 179.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' A' ' 22' ' ' THR . 0.3 OUTLIER -100.7 155.44 17.89 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 109.912 -0.403 . . . . 1.71 109.912 179.874 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.441 HD12 ' O ' ' A' ' 18' ' ' GLU . 92.2 mt -59.63 -38.32 81.04 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.828 0.346 . . . . 1.49 111.475 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -67.27 -20.31 65.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.267 -0.424 . . . . 1.94 111.757 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -69.18 -31.91 70.85 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.818 0.342 . . . . 2.03 110.677 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -98.08 9.86 41.83 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.195 -0.457 . . . . 1.76 111.4 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 65.02 29.36 12.22 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.952 -0.567 . . . . 2.96 111.142 -179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 83.0 mt -77.47 121.09 29.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.988 -0.551 . . . . 1.65 110.249 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -113.24 -164.35 0.91 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.588 -0.733 . . . . 2.66 110.155 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.403 ' HB3' ' HB2' ' A' ' 1' ' ' MET . 56.9 pttt -73.64 147.53 43.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.596 0.236 . . . . 3.22 110.43 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 64.28 28.97 13.87 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.99 0.737 . . . . 3.12 112.99 179.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 50.4 m -84.38 140.81 31.31 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.577 -0.527 . . . . 1.83 109.577 178.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -94.18 114.29 26.38 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.431 -0.35 . . . . 2.03 111.305 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 7.0 mp -106.52 141.71 37.36 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.158 -0.682 . . . . 1.41 109.158 178.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.427 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 75.0 m80 -106.74 147.21 29.9 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 111.53 0.196 . . . . 2.76 111.53 -179.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 27.7 tp -120.8 116.33 25.01 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.095 0.474 . . . . 1.54 111.482 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.486 ' CG2' HD11 ' A' ' 44' ' ' ILE . 0.9 OUTLIER -96.29 143.2 12.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.819 -0.628 . . . . 1.79 110.004 179.104 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 12.4 mt -86.49 134.92 33.63 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.172 -0.467 . . . . 2.43 111.314 -179.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.457 ' HB3' ' HA ' ' A' ' 40' ' ' GLN . 0.2 OUTLIER -112.48 129.94 56.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.034 -0.53 . . . . 3.19 110.359 179.303 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.638 HD12 ' HB3' ' B' ' 420' ' ' GLU . 5.9 mt -118.41 155.36 30.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.882 0.372 . . . . 2.99 111.39 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 32.0 mmt180 -96.73 -52.96 3.71 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.116 -0.493 . . . . 3.67 110.002 178.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -144.75 145.82 15.6 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.91 -0.662 . . . . 3.08 112.082 179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.885 0 N-CA-C 110.906 -0.878 . . . . 3.82 110.906 179.76 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.871 0 N-CA-C 112.041 -0.424 . . . . 5.66 112.041 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.08 98.27 5.71 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.807 0.337 . . . . 5.53 110.73 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -154.06 96.55 1.97 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.264 -0.425 . . . . 3.98 111.113 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . 0.406 ' O ' ' HD3' ' B' ' 391' ' ' PRO . 0.2 OUTLIER -82.87 0.82 42.37 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.178 0.513 . . . . 4.15 110.45 179.212 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 390' ' ' PHE . . . . . . . . . . . . . 29.2 m-85 -107.16 101.26 37.3 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.726 -0.67 . . . . 2.51 109.733 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 391' ' ' PRO . . . . . 0.406 ' HD3' ' O ' ' B' ' 389' ' ' THR . 18.4 Cg_exo -67.52 130.04 21.39 Favored 'Trans proline' 0 C--O 1.235 0.366 0 C-N-CA 122.55 2.167 . . . . 3.77 111.124 179.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -54.1 -39.23 66.19 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.164 -0.471 . . . . 5.36 111.038 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 393' ' ' GLN . . . . . 0.418 ' O ' ' HG2' ' B' ' 397' ' ' GLN . 8.6 tt0 -59.38 -51.11 71.33 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.778 -0.647 . . . . 6.89 110.301 179.364 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 26.1 m -59.24 -45.25 91.67 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.907 -0.588 . . . . 4.2 111.091 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 395' ' ' ILE . . . . . 0.482 ' O ' ' HG2' ' B' ' 399' ' ' MET . 78.3 mt -58.09 -49.02 82.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 3.8 110.561 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 85.8 mttt -60.0 -42.26 93.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.17 -0.468 . . . . 6.27 112.001 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 397' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' B' ' 393' ' ' GLN . 21.6 mm-40 -62.87 -41.24 99.31 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.887 0.375 . . . . 6.91 110.981 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 398' ' ' LEU . . . . . . . . . . . . . 80.8 mt -72.79 -26.49 61.54 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.083 -0.508 . . . . 4.31 111.464 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 399' ' ' MET . . . . . 0.482 ' HG2' ' O ' ' B' ' 395' ' ' ILE . 30.7 mmt -62.35 -40.25 95.77 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.315 -0.402 . . . . 5.8 111.293 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -70.45 -17.79 62.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.865 -0.607 . . . . 7.71 112.138 -178.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 401' ' ' LEU . . . . . 0.491 HD22 HD12 ' A' ' 44' ' ' ILE . 94.5 mt -69.51 -16.26 63.41 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.837 0.351 . . . . 5.69 111.75 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 96.87 32.57 6.45 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.711 -0.757 . . . . 5.87 112.178 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 403' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -126.4 144.58 49.86 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 110.486 -0.191 . . . . 4.83 110.486 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -72.77 162.78 40.26 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.697 2.265 . . . . 4.72 111.999 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' B' ' 405' ' ' ARG . 14.2 ttt180 -63.51 -28.3 69.86 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.835 -0.62 . . . . 4.16 111.033 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -56.21 -48.88 75.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.862 -0.608 . . . . 4.69 111.209 179.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -64.94 -35.74 82.12 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.824 -0.625 . . . . 2.99 110.644 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 408' ' ' VAL . . . . . . . . . . . . . 73.9 t -63.22 -50.54 78.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.823 -0.626 . . . . 2.06 110.796 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 59.8 t -60.2 -44.31 95.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 116.502 -0.317 . . . . 2.89 111.403 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 78.2 mttt -64.15 -50.4 68.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.296 -0.411 . . . . 5.05 111.72 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -63.54 -50.04 71.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.199 -0.455 . . . . 2.96 111.703 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -59.59 -30.45 68.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.332 -0.395 . . . . 3.45 111.969 -179.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 23.5 mmtt -67.35 -48.3 67.88 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.418 -0.355 . . . . 5.52 111.128 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 23.8 pt20 -76.09 -30.96 58.48 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 113.147 0.795 . . . . 5.53 113.147 -179.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 415' ' ' THR . . . . . 0.512 ' HB ' ' ND2' ' B' ' 418' ' ' ASN . 65.4 p -84.02 -8.14 59.21 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.007 0.432 . . . . 5.42 110.915 179.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 61.96 61.1 1.42 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.366 -0.834 . . . . 6.37 112.811 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . . . . . . . . . . . 74.27 -23.15 1.2 Allowed Glycine 0 CA--C 1.521 0.41 0 CA-C-N 115.493 -0.776 . . . . 4.33 114.928 178.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 418' ' ' ASN . . . . . 0.799 HD21 ' HB2' ' B' ' 421' ' ' PHE . 0.0 OUTLIER -68.91 113.43 6.32 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 117.868 0.834 . . . . 6.25 111.807 -179.291 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 419' ' ' ALA . . . . . 0.458 ' HA ' ' HB3' ' B' ' 422' ' ' ALA . . . -73.29 -20.61 60.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 114.942 -1.026 . . . . 4.12 112.274 -178.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 420' ' ' GLU . . . . . 0.638 ' HB3' HD12 ' A' ' 73' ' ' LEU . 53.2 mm-40 -61.93 -55.63 27.53 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.36 0.6 . . . . 6.99 110.041 -179.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 421' ' ' PHE . . . . . 0.799 ' HB2' HD21 ' B' ' 418' ' ' ASN . 11.2 m-85 -75.13 -24.56 58.01 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.679 -0.692 . . . . 7.48 110.4 179.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 422' ' ' ALA . . . . . 0.462 ' O ' ' HG ' ' B' ' 426' ' ' LEU . . . -61.61 -46.69 88.74 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.003 -0.739 . . . . 3.68 109.003 178.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . 0.485 ' HB1' HG13 ' A' ' 70' ' ' VAL . . . -64.47 -38.84 92.43 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 115.85 -0.613 . . . . 3.8 109.693 179.03 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 49.1 m -66.98 -31.3 71.77 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.049 -0.523 . . . . 5.05 110.781 178.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 425' ' ' LEU . . . . . 0.548 ' O ' ' HG2' ' B' ' 428' ' ' GLN . 0.4 OUTLIER -81.65 -49.41 10.52 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.773 0.657 . . . . 4.36 112.773 -179.507 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 426' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' B' ' 422' ' ' ALA . 4.2 pp -64.88 -33.82 76.92 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 114.599 1.333 . . . . 3.21 114.599 -177.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 427' ' ' PHE . . . . . 0.501 ' CE1' HG12 ' A' ' 44' ' ' ILE . 62.5 t80 -76.34 0.74 18.36 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 113.174 0.805 . . . . 5.27 113.174 -178.322 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 428' ' ' GLN . . . . . 0.548 ' HG2' ' O ' ' B' ' 425' ' ' LEU . 2.1 pt20 -50.93 -46.05 60.73 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.956 0.724 . . . . 5.32 112.956 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 9.5 m . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.549 -0.739 . . . . 5.11 110.361 -179.951 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.1 ptt? . . . . . 0 N--CA 1.481 1.09 0 CA-C-O 120.623 0.249 . . . . 1.65 110.365 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 85.1 mm-40 -105.93 135.18 47.84 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.864 0.364 . . . . 1.92 111.753 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 21.1 pt -129.75 165.22 30.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 109.316 -0.624 . . . . 1.48 109.316 178.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.454 ' O ' ' HA ' ' A' ' 66' ' ' THR . 87.6 m-85 -122.54 127.5 49.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.646 0.26 . . . . 2.17 110.622 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.472 ' HB ' ' HB ' ' A' ' 13' ' ' ILE . 44.3 t -110.17 124.84 67.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 116.504 -0.317 . . . . 1.65 110.331 179.593 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.402 ' HE3' HG21 ' A' ' 66' ' ' THR . 75.0 mttt -91.71 149.63 21.52 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.417 -0.356 . . . . 3.16 110.625 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.3 p -126.1 167.84 14.82 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.988 -0.551 . . . . 2.17 109.605 179.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 33.0 mt -65.22 -23.3 67.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.067 0.461 . . . . 3.05 110.454 179.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.4 -5.53 56.63 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.572 -0.74 . . . . 2.7 111.124 179.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.18 30.12 57.59 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 121.051 -0.595 . . . . 2.64 112.523 179.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -104.42 129.77 52.36 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 122.774 -0.251 . . . . 2.34 110.574 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.2 m -87.85 112.01 22.02 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.316 -0.402 . . . . 2.31 110.388 179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.472 ' HB ' ' HB ' ' A' ' 5' ' ' VAL . 49.0 mt -96.59 116.07 37.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 116.402 -0.363 . . . . 1.83 110.6 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.58 126.93 32.85 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.717 -0.845 . . . . 2.02 108.717 178.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.511 HD11 HG12 ' A' ' 30' ' ' ILE . 11.5 mt -126.96 139.2 53.21 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.988 0.736 . . . . 1.33 112.988 -178.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -95.13 106.74 18.77 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 114.855 -1.066 . . . . 2.4 108.716 178.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 6.4 m -140.61 171.05 13.59 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-O 120.87 0.366 . . . . 1.25 110.777 -179.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -124.34 153.35 68.9 Favored Pre-proline 0 C--N 1.319 -0.721 0 N-CA-C 108.903 -0.777 . . . . 1.85 108.903 178.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_exo -53.49 -35.87 77.77 Favored 'Trans proline' 0 CA--C 1.53 0.305 0 C-N-CA 122.45 2.1 . . . . 1.78 112.177 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.1 m -85.02 14.56 4.82 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.54 0.571 . . . . 1.8 112.54 -179.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -92.61 135.69 33.86 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.213 -0.662 . . . . 1.23 109.213 178.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.45 147.79 37.68 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.269 -0.423 . . . . 1.44 111.272 -178.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.565 ' HB ' ' HA ' ' A' ' 52' ' ' ASP . 47.3 mm -56.35 -37.41 50.62 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.12 0 CA-C-N 116.48 -0.327 . . . . 0.99 110.661 179.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.493 ' HB2' ' HB3' ' A' ' 52' ' ' ASP . 28.4 tt0 -57.76 -40.5 79.92 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.244 -0.435 . . . . 2.22 110.673 179.257 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -69.34 -35.13 75.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.023 -0.535 . . . . 1.23 109.839 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.459 ' O ' HG13 ' A' ' 30' ' ' ILE . 59.7 t -65.54 -41.72 91.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 109.133 -0.692 . . . . 0.64 109.133 178.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.545 ' HE3' ' HB2' ' A' ' 41' ' ' GLN . 2.4 mmmm -60.98 -40.37 93.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.737 -0.665 . . . . 1.32 109.713 178.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -66.47 -36.26 82.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.82 -0.627 . . . . 1.08 110.173 179.127 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -65.74 -35.82 81.82 Favored 'General case' 0 C--N 1.334 -0.082 0 CA-C-N 116.132 -0.485 . . . . 1.08 110.112 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.511 HG12 HD11 ' A' ' 15' ' ' LEU . 79.5 mt -69.79 -38.31 75.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 108.801 -0.814 . . . . 1.31 108.801 178.264 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -63.95 -30.4 71.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.529 -0.759 . . . . 1.93 110.473 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -70.41 -17.25 63.01 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.005 -0.543 . . . . 2.05 110.824 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -107.6 -54.34 2.5 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.105 -0.498 . . . . 2.17 112.014 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -79.12 -36.19 41.02 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 111.916 0.339 . . . . 2.14 111.916 -178.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 94.87 -15.65 62.95 Favored Glycine 0 C--O 1.229 -0.189 0 C-N-CA 120.836 -0.697 . . . . 2.01 112.03 -179.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.402 ' HA ' ' HD3' ' A' ' 37' ' ' PRO . 54.2 mt -69.56 126.61 92.7 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-N 115.905 -0.148 . . . . 1.83 110.746 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.425 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 45.5 Cg_exo -58.68 145.87 94.07 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 123.124 2.549 . . . . 2.04 112.235 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 37' ' ' PRO . 37.1 Cg_exo -60.05 -21.51 65.6 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.263 2.642 . . . . 1.52 112.638 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.55 -19.76 65.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.265 -0.425 . . . . 2.95 111.735 -179.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -114.01 9.06 17.29 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.086 0.469 . . . . 2.56 110.249 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.545 ' HB2' ' HE3' ' A' ' 27' ' ' LYS . 67.5 mt-30 -98.85 108.84 21.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.622 -0.717 . . . . 1.4 110.925 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.557 ' HB3' ' CD2' ' B' ' 427' ' ' PHE . 11.1 mmt85 -104.8 104.43 14.21 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.019 0.438 . . . . 2.65 109.866 178.524 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.637 ' HB3' HD12 ' A' ' 50' ' ' LEU . 9.9 mt -102.15 134.65 45.06 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.741 -0.663 . . . . 1.02 111.699 -178.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.801 HG22 ' HA ' ' A' ' 49' ' ' GLN . 10.8 pt -138.73 160.97 30.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.989 -0.55 . . . . 2.14 110.185 178.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.495 ' HB2' HD21 ' A' ' 50' ' ' LEU . 53.6 t80 -134.91 106.24 6.77 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.423 -0.584 . . . . 1.71 109.423 179.051 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . 60.92 33.42 19.87 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.086 -0.506 . . . . 2.1 111.725 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 99.95 -31.48 8.38 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.888 -0.673 . . . . 1.84 113.408 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -78.42 130.27 35.9 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.849 0.324 . . . . 3.05 111.404 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.801 ' HA ' HG22 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -67.77 140.94 56.68 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.914 -0.585 . . . . 2.3 110.529 179.851 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.637 HD12 ' HB3' ' A' ' 43' ' ' LEU . 72.0 mt -97.58 113.01 24.65 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.57 -0.286 . . . . 1.17 110.798 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.621 ' HB2' ' HG2' ' A' ' 54' ' ' ARG . 17.7 mt-10 -76.87 133.06 39.41 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.282 -0.417 . . . . 2.65 109.978 179.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.565 ' HA ' ' HB ' ' A' ' 23' ' ' ILE . 4.1 m-20 -58.94 -29.13 66.9 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.919 -0.582 . . . . 1.83 112.209 -179.198 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -81.53 2.16 83.36 Favored Glycine 0 CA--C 1.52 0.354 0 C-N-CA 121.055 -0.593 . . . . 1.82 113.719 -179.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.621 ' HG2' ' HB2' ' A' ' 51' ' ' GLU . 15.7 mmt180 -107.99 166.12 10.96 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 117.073 0.437 . . . . 2.69 110.328 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 76.9 p -105.04 177.39 4.86 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.782 -0.451 . . . . 1.71 109.782 179.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.458 ' HB3' ' HB ' ' A' ' 61' ' ' ILE . 94.8 mt -67.19 -34.87 78.42 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.971 0.415 . . . . 1.49 109.882 179.071 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.71 -27.47 68.93 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.958 -0.565 . . . . 1.94 111.368 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -65.23 -23.34 67.04 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.908 0.385 . . . . 2.03 111.704 -179.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -115.03 16.07 17.13 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.386 -0.37 . . . . 1.76 110.929 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 59.66 29.09 18.64 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 115.769 -0.651 . . . . 2.96 111.658 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.458 ' HB ' ' HB3' ' A' ' 56' ' ' LEU . 76.7 mt -77.48 119.61 26.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.044 -0.526 . . . . 1.65 110.335 -179.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 15.0 mt-30 -110.96 -167.99 1.25 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.67 -0.695 . . . . 2.66 109.496 -179.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 24.0 pttt -73.3 152.73 40.84 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 121.01 -0.276 . . . . 3.22 110.412 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 70.4 -1.53 2.48 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 112.574 0.583 . . . . 3.12 112.574 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 69.1 m -69.88 137.19 51.45 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 110.235 -0.283 . . . . 1.83 110.235 179.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.454 ' HA ' ' O ' ' A' ' 4' ' ' PHE . 3.4 m -96.57 120.41 36.84 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.168 0.509 . . . . 2.03 111.713 -179.202 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 9.7 mp -98.73 156.43 16.84 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.551 -0.907 . . . . 1.41 108.551 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.435 ' HB2' HG13 ' A' ' 44' ' ' ILE . 72.7 m80 -117.03 125.44 51.35 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.862 0.363 . . . . 2.76 111.937 -179.124 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.473 HD13 ' HG ' ' A' ' 43' ' ' LEU . 47.5 tp -115.58 120.36 39.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.921 -0.582 . . . . 1.54 110.521 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.2 t -112.74 138.89 40.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.005 -0.543 . . . . 1.79 110.678 179.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 55.8 mt -72.05 122.82 21.58 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.84 -0.618 . . . . 2.43 110.343 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 59.3 ttt180 -89.92 104.5 17.06 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.29 -0.414 . . . . 3.19 110.553 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.4 mp -69.29 113.35 6.55 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.909 -0.587 . . . . 2.99 110.546 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.4 ' HD2' HH11 ' A' ' 74' ' ' ARG . 8.6 mmt85 -82.81 -19.49 37.58 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.05 -0.523 . . . . 3.67 110.317 179.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -163.27 151.32 20.89 Favored Glycine 0 N--CA 1.443 -0.894 0 N-CA-C 111.258 -0.737 . . . . 3.08 111.258 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . 0.555 ' HA3' ' HE2' ' B' ' 421' ' ' PHE . . . . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.586 -1.119 . . . . 3.82 111.651 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 386' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.655 0 N-CA-C 111.553 -0.619 . . . . 5.66 111.553 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 387' ' ' SER . . . . . . . . . . . . . 2.3 m -124.9 36.5 4.59 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.083 0.468 . . . . 5.53 110.473 -179.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 388' ' ' ALA . . . . . . . . . . . . . . . -104.02 109.36 21.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.146 -0.479 . . . . 3.98 110.614 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 389' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.74 -14.49 51.46 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.336 0.589 . . . . 4.15 110.547 179.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 390' ' ' PHE . . . . . 0.613 ' HB2' HD11 ' B' ' 395' ' ' ILE . 0.1 OUTLIER -99.34 111.31 60.94 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.633 -0.712 . . . . 2.51 110.423 -179.694 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 391' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' B' ' 390' ' ' PHE . 10.5 Cg_exo -71.42 136.27 28.33 Favored 'Trans proline' 0 C--O 1.237 0.434 0 C-N-CA 122.792 2.328 . . . . 3.77 111.44 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 392' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.75 -36.14 69.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.231 -0.441 . . . . 5.36 112.066 -179.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 393' ' ' GLN . . . . . 0.403 HE21 ' HB3' ' B' ' 393' ' ' GLN . 4.2 tt0 -56.79 -52.89 63.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.045 0.45 . . . . 6.89 110.9 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 394' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -67.47 -36.24 80.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.886 -0.597 . . . . 4.2 110.948 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 395' ' ' ILE . . . . . 0.613 ' O ' ' HG2' ' B' ' 399' ' ' MET . 74.1 mt -59.59 -52.28 62.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-N 116.058 -0.519 . . . . 3.8 110.224 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 396' ' ' LYS . . . . . . . . . . . . . 31.8 mttp -56.29 -42.7 77.94 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.355 -0.384 . . . . 6.27 111.445 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 397' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -61.95 -39.01 90.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.276 -0.42 . . . . 6.91 111.23 179.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 398' ' ' LEU . . . . . 0.413 HD12 HG23 ' B' ' 408' ' ' VAL . 90.4 mt -76.71 -31.67 57.35 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.401 -0.363 . . . . 4.31 111.316 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 399' ' ' MET . . . . . 0.613 ' HG2' ' O ' ' B' ' 395' ' ' ILE . 35.0 mmt -66.97 -39.96 87.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.075 0.464 . . . . 5.8 110.0 179.388 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 400' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -62.38 -28.26 69.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.572 -0.74 . . . . 7.71 111.975 -179.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 401' ' ' LEU . . . . . 0.769 ' HB3' HD11 ' A' ' 44' ' ' ILE . 38.2 mt -63.69 -26.83 68.84 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.071 0.462 . . . . 5.69 110.59 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 402' ' ' GLY . . . . . . . . . . . . . . . 111.61 27.1 4.23 Favored Glycine 0 N--CA 1.446 -0.638 0 N-CA-C 111.483 -0.647 . . . . 5.87 111.483 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 403' ' ' PHE . . . . . 0.569 ' HE2' HD13 ' A' ' 44' ' ' ILE . 33.4 m-85 -113.08 143.21 28.72 Favored Pre-proline 0 C--N 1.326 -0.431 0 CA-C-O 120.652 0.263 . . . . 4.83 110.91 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 404' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -75.88 164.62 31.45 Favored 'Trans proline' 0 C--O 1.236 0.418 0 C-N-CA 123.022 2.481 . . . . 4.72 112.949 -179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 405' ' ' ARG . . . . . 0.501 ' HA ' HG12 ' B' ' 408' ' ' VAL . 91.0 mtt180 -64.12 -28.26 69.65 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.796 -0.638 . . . . 4.16 111.408 179.659 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 406' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -63.32 -37.71 88.33 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.011 0.434 . . . . 4.69 110.448 179.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 407' ' ' ALA . . . . . . . . . . . . . . . -68.56 -45.19 72.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.8 -0.637 . . . . 2.99 111.453 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 408' ' ' VAL . . . . . 0.501 HG12 ' HA ' ' B' ' 405' ' ' ARG . 14.6 p -63.22 -41.23 92.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 N-CA-C 112.091 0.404 . . . . 2.06 112.091 -179.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 409' ' ' VAL . . . . . . . . . . . . . 74.7 t -64.23 -50.23 77.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.902 0.382 . . . . 2.89 111.143 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 410' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -62.85 -40.52 97.69 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.295 -0.411 . . . . 5.05 111.706 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 411' ' ' ALA . . . . . . . . . . . . . . . -67.89 -45.43 74.47 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.296 -0.411 . . . . 2.96 110.979 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 412' ' ' LEU . . . . . 0.449 HD13 ' HA2' ' B' ' 417' ' ' GLY . 0.8 OUTLIER -61.26 -33.72 74.0 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.198 -0.456 . . . . 3.45 111.543 -179.671 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 413' ' ' LYS . . . . . . . . . . . . . 42.3 mmtt -69.76 -50.81 39.67 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.121 0.415 . . . . 5.52 112.121 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 414' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -70.29 -23.83 62.93 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 113.17 0.804 . . . . 5.53 113.17 -178.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 415' ' ' THR . . . . . 0.475 HG21 ' HA ' ' B' ' 422' ' ' ALA . 68.6 p -99.01 -5.02 31.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.005 0.431 . . . . 5.42 110.973 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 416' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 57.76 61.72 2.33 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.494 -0.775 . . . . 6.37 112.96 179.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 417' ' ' GLY . . . . . 0.449 ' HA2' HD13 ' B' ' 412' ' ' LEU . . . 76.92 -14.46 7.46 Favored Glycine 0 CA--C 1.519 0.314 0 N-CA-C 114.902 0.721 . . . . 4.33 114.902 177.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 418' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -71.32 94.16 1.19 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 117.733 0.767 . . . . 6.25 110.166 -179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 419' ' ' ALA . . . . . . . . . . . . . . . -61.79 -33.34 73.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.089 -0.505 . . . . 4.12 111.853 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 420' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -65.91 -43.43 88.2 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.238 0.542 . . . . 6.99 109.628 -179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 421' ' ' PHE . . . . . 0.555 ' HE2' ' HA3' ' A' ' 76' ' ' GLY . 0.2 OUTLIER -73.53 -36.99 65.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.701 -0.681 . . . . 7.48 109.6 179.211 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 422' ' ' ALA . . . . . 0.475 ' HA ' HG21 ' B' ' 415' ' ' THR . . . -59.28 -47.02 86.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.834 -0.621 . . . . 3.68 110.529 179.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 423' ' ' ALA . . . . . . . . . . . . . . . -60.23 -46.31 90.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.154 -0.475 . . . . 3.8 110.436 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 424' ' ' SER . . . . . . . . . . . . . 61.3 m -65.38 -29.18 69.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.201 -0.454 . . . . 5.05 111.519 179.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 425' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -80.69 -49.71 10.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.416 -0.356 . . . . 4.36 111.947 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 426' ' ' LEU . . . . . . . . . . . . . 4.2 pp -64.09 -33.03 74.84 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.927 0.343 . . . . 3.21 111.927 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 427' ' ' PHE . . . . . 0.557 ' CD2' ' HB3' ' A' ' 42' ' ' ARG . 2.0 m-85 -63.07 -11.03 16.79 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.772 0.656 . . . . 5.27 112.772 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 428' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -67.05 -20.55 65.86 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.764 0.316 . . . . 5.32 110.943 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 429' ' ' SER . . . . . . . . . . . . . 1.6 m . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.775 -0.631 . . . . 5.11 110.741 179.984 . . . . . . . . 0 0 . 1 stop_ save_